CC(=O)CNC(=O)C1=CN=CC=C1
CAS: 52829-64-8
名称: N-(2-oxopropyl)pyridine-3-carboxamide
SMILES: CC(=O)CNC(=O)C1=CN=CC=C1

Molecular Processing

Molecular formula
C9H10N2O2
Molecular weight
178.19
Exact mass
178.0742
XLogP
0.4
TPSA
59.06
H-bond donors
1
H-bond acceptors
3
Rotatable bonds
3
Heavy atoms
13
Rings
1
Aromatic rings
1
Saturated rings
0
Aliphatic rings
0
Stereo centers
0
Undefined stereo
0
Formal charge
0
Heteroatoms
4
Covalent units
1
Fraction Csp3
0.222
Molar refractivity
47.25

Supplementary Information

InChIKey: UZGZESGIRAPRFT-UHFFFAOYSA-N
同義語
N-Acetylmethyl-nicotinamideSCHEMBL8403704UZGZESGIRAPRFT-UHFFFAOYSA-NAKOS01432906352829-64-8DB-371323
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