Molecular Identity
ISONICOTINIC ACID
pyridine-4-carboxylic acid
PubChem CID: 5922
Isonicotinic acid is a pyridinemonocarboxylic acid in which the carboxy group is at position 4 of the pyridine ring. It has a role as a human metabolite and an algal metabolite. It is a conjugate acid of an isonicotinate.
2D Structure
Properties
C6H5NO2
Molecular Formula
123.11
Molecular Weight
g/mol
123.0320
Exact Mass
Da
0.4
XLogP
Drug-like (Lipinski: < 5)
50.2
TPSA
Good oral absorption (< 140 A²)
1
H-Bond Donors
3
H-Bond Acceptors
108
Complexity
SMILES
Canonical SMILES
SMILES: Synonyms(20)
ISONICOTINIC ACID55-22-14-Pyridinecarboxylic acidPyridine-4-carboxylic acid4-Carboxypyridinegamma-Picolinic acidp-Pyridinecarboxylic acidgamma-Pyridinecarboxylic acidDTXSID8020757NSC-1483Y8SYN761TQDTXCID80757CHEBI:6032Acid, IsonicotinicRefChem:791922
Data from PubChem (NCBI)
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Drug Network
Trials and conditions connected to ISONICOTINIC ACID
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