이름: 4-methyl-7-(2-methylphenyl)-5-oxo-cyclopenta[2,1-b]pyridine
SMILES:
Cc1ccccc1C1=CC(=O)c2c(C)ccnc21Molecular Processing
Molecular formula
C16H13NO
Molecular weight
235.29
Exact mass
235.0997
XLogP
3.33
TPSA
29.96
H-bond donors
0
H-bond acceptors
2
Rotatable bonds
1
Heavy atoms
18
Rings
3
Aromatic rings
2
Saturated rings
0
Aliphatic rings
1
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
2
Covalent units
1
Fraction Csp3
0.125
Molar refractivity
71.56
Supplementary Information
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