Compound 282
  CheckMol                        TMF02:r0:m0
MF=C13H12N2O MW=212.25
 16 17  0  2  0               999 V2000
    0.0000   -0.0000   -0.0000 O   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0118    1.5067   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -1.3184    2.2601   -0.0000 N   0  0  0  0  0  0  0  0  0  0  0  0
    1.2713    2.2601   -0.0000 C   0  0  0  0  0  0  0  0  0  0  0  0
   -2.6250    1.5303   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3301    3.7668   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9316    2.2954   -0.0000 N   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6368    0.0471   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0471    4.5202   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6368    4.5202   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2382    1.5656   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -3.9434   -0.6827   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -0.0589    6.0269   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -2.6485    6.0269   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -5.2500    0.0824   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
   -1.3655    6.7802   -0.0000 C   0 00  0  0  0  0  0  0  0  0  0  0
  1  2  2  0  0  0  0
  2  3  1  0  0  0  0
  2  4  1  0  0  0  0
  3  5  1  0  0  0  0
  3  6  1  0  0  0  0
  5  7 02  0  1  0  0
  5  8 01  0  1  0  0
  6  9 02  0  1  0  0
  6 10 01  0  1  0  0
  7 11 01  0  1  0  0
  8 12 02  0  1  0  0
  9 13 01  0  1  0  0
 10 14 02  0  1  0  0
 11 15 02  0  1  0  0
 13 16 02  0  1  0  0
 12 15 01  0  1  0  0
 14 16 01  0  1  0  0
M  END

2D Structure

Phenyl Pyridyl Acetamide

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Chemical Name - Phenyl Pyridyl Acetamide
Mol Weight - 212.251
Smiles - CC(N(c1ccccc1)c1ncccc1)=O

Property Name	Property Value
Mol Name	Phenyl Pyridyl Acetamide
Molweight	212.251
Monoisotopic Mass	212.094963
Clogp	1.6222
Clogs	-3.684
H Acceptors	3
Total Surface Area	172.09
Relative Psa	0.16015
Polar Surface Area	33.2
Druglikeness	1.1692
Mutagenic	none
Tumorigenic	none
Reproductive Effective	none
Irritant	none
Shape Index	0.5625
Molecular Flexibility	0.42803
Molecular Complexity	0.6715
Fragments	1
Non H Atoms	16
Non Ch Atoms	3
Electronegative Atoms	3
Rotatable Bonds	2
Rings Closures	2
Small Rings	2
Aromatic Rings	2
Aromatic Atoms	12
Sp3 Atoms	1
Symmetric Atoms	2
Amides	1
Aromatic Nitrogens	1
Smiles	CC(N(c1ccccc1)c1ncccc1)=O
InChIKey	InChI=1S/C13H12N2O/c1-11(16)15(12-7-3-2-4-8-12)13-9-5-6-10-14-13/h2-10H,1H3
InChI	QSLVWXYSQSGOHK-UHFFFAOYSA-N

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