5732
  -OEChem-10191521282D

 44 46  0     0  0  0  0  0  0999 V2000
    4.2086    0.6961    0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -1.0972    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5443   -2.4019    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.4978    1.8529    0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    5.5443   -0.7925    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.1279   -1.5972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.5981   -2.0972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.8550    0.1581    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.1279   -1.5972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -0.5972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -1.0972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -2.5972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    5.1871    0.9024    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.8660   -2.0972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6279   -2.4632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    7.6279   -0.7312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    2.0000   -0.5972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    9.1279   -1.5972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6279   -2.4632    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    8.6279   -0.7312    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    4.8299    2.5972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4763    2.0591    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   10.1279   -1.5972    0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
    6.4019   -0.1340    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.2375    0.6460    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320    0.0228    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    3.7320   -3.2172    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3291   -2.4072    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3179   -3.0002    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.3179   -0.1942    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    2.3100   -0.0603    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.4631   -0.2872    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    1.6900   -1.1341    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9379   -3.0002    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    8.9379   -0.1942    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    5.2914    3.0112    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.4159    3.0587    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    4.3685    2.1831    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.6041    1.4524    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    7.0830    2.1870    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
    6.3484    2.6658    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1279   -2.2172    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.7479   -1.5972    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
   10.1279   -0.9772    0.0000 H   0  0  0  0  0  0  0  0  0  0  0  0
  1 13  2  0  0  0  0
  2  5  1  0  0  0  0
  2  7  1  0  0  0  0
  2 10  1  0  0  0  0
  3  6  1  0  0  0  0
  3  7  2  0  0  0  0
  4 13  1  0  0  0  0
  4 21  1  0  0  0  0
  4 22  1  0  0  0  0
  5  6  2  0  0  0  0
  5  8  1  0  0  0  0
  6  9  1  0  0  0  0
  7 12  1  0  0  0  0
  8 13  1  0  0  0  0
  8 24  1  0  0  0  0
  8 25  1  0  0  0  0
  9 15  2  0  0  0  0
  9 16  1  0  0  0  0
 10 11  2  0  0  0  0
 10 26  1  0  0  0  0
 11 14  1  0  0  0  0
 11 17  1  0  0  0  0
 12 14  2  0  0  0  0
 12 27  1  0  0  0  0
 14 28  1  0  0  0  0
 15 19  1  0  0  0  0
 15 29  1  0  0  0  0
 16 20  2  0  0  0  0
 16 30  1  0  0  0  0
 17 31  1  0  0  0  0
 17 32  1  0  0  0  0
 17 33  1  0  0  0  0
 18 19  2  0  0  0  0
 18 20  1  0  0  0  0
 18 23  1  0  0  0  0
 19 34  1  0  0  0  0
 20 35  1  0  0  0  0
 21 36  1  0  0  0  0
 21 37  1  0  0  0  0
 21 38  1  0  0  0  0
 22 39  1  0  0  0  0
 22 40  1  0  0  0  0
 22 41  1  0  0  0  0
 23 42  1  0  0  0  0
 23 43  1  0  0  0  0
 23 44  1  0  0  0  0
M  END
> <PUBCHEM_COMPOUND_CID>
5732

> <PUBCHEM_COMPOUND_CANONICALIZED>
1

> <PUBCHEM_CACTVS_COMPLEXITY>
417

> <PUBCHEM_CACTVS_HBOND_ACCEPTOR>
2

> <PUBCHEM_CACTVS_HBOND_DONOR>
0

> <PUBCHEM_CACTVS_ROTATABLE_BOND>
3

> <PUBCHEM_CACTVS_SUBSKEYS>
AAADceB7IAAAAAAAAAAAAAAAAAAAAWAAAAA8QAAAAAAAAFgB8AAAHgAAAAAADAjBnwQ/sJ8MGACoAzd3dACCgC0xEqAJ2CE4dJiIaPrA3ZGUIAhoggLIyCcciMCOQAAAAAAAAACAAAAAAAAAAAAAAAAAAA==

> <PUBCHEM_IUPAC_OPENEYE_NAME>
N,N-dimethyl-2-[6-methyl-2-(p-tolyl)imidazo[1,2-a]pyridin-3-yl]acetamide

> <PUBCHEM_IUPAC_CAS_NAME>
N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)-3-imidazo[1,2-a]pyridinyl]acetamide

> <PUBCHEM_IUPAC_NAME>
N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide

> <PUBCHEM_IUPAC_SYSTEMATIC_NAME>
N,N-dimethyl-2-[6-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]ethanamide

> <PUBCHEM_IUPAC_TRADITIONAL_NAME>
N,N-dimethyl-2-[6-methyl-2-(p-tolyl)imidazo[1,2-a]pyridin-3-yl]acetamide

> <PUBCHEM_IUPAC_INCHI>
InChI=1S/C19H21N3O/c1-13-5-8-15(9-6-13)19-16(11-18(23)21(3)4)22-12-14(2)7-10-17(22)20-19/h5-10,12H,11H2,1-4H3

> <PUBCHEM_IUPAC_INCHIKEY>
ZAFYATHCZYHLPB-UHFFFAOYSA-N

> <PUBCHEM_XLOGP3>
2.5

> <PUBCHEM_EXACT_MASS>
307.168462

> <PUBCHEM_MOLECULAR_FORMULA>
C19H21N3O

> <PUBCHEM_MOLECULAR_WEIGHT>
307.38954

> <PUBCHEM_OPENEYE_CAN_SMILES>
CC1=CC=C(C=C1)C2=C(N3C=C(C=CC3=N2)C)CC(=O)N(C)C

> <PUBCHEM_OPENEYE_ISO_SMILES>
CC1=CC=C(C=C1)C2=C(N3C=C(C=CC3=N2)C)CC(=O)N(C)C

> <PUBCHEM_CACTVS_TPSA>
37.6

> <PUBCHEM_MONOISOTOPIC_WEIGHT>
307.168462

> <PUBCHEM_TOTAL_CHARGE>
0

> <PUBCHEM_HEAVY_ATOM_COUNT>
23

> <PUBCHEM_ATOM_DEF_STEREO_COUNT>
0

> <PUBCHEM_ATOM_UDEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_DEF_STEREO_COUNT>
0

> <PUBCHEM_BOND_UDEF_STEREO_COUNT>
0

> <PUBCHEM_ISOTOPIC_ATOM_COUNT>
0

> <PUBCHEM_COMPONENT_COUNT>
1

> <PUBCHEM_CACTVS_TAUTO_COUNT>
1

> <PUBCHEM_COORDINATE_TYPE>
1
5
255

> <PUBCHEM_BONDANNOTATIONS>
10  11  8
11  14  8
12  14  8
15  19  8
16  20  8
18  19  8
18  20  8
2  10  8
2  5  8
2  7  8
3  6  8
3  7  8
5  6  8
7  12  8
9  15  8
9  16  8

$$$$