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name Structure Reference Source Properties Activities Metabolism

4-Pyridinecarboxylic acid; Amide

AlkaPlorer ID: AK000742

Synonym: Isonicotinamide

IUPAC Name: pyridine-4-carboxamide

Structure

SMILES: NC(=O)C1=CC=NC=C1

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InChI: InChI=1S/C6H6N2O/c7-6(9)5-1-3-8-4-2-5/h1-4H,(H2,7,9)

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InChIKey: VFQXVTODMYMSMJ-UHFFFAOYSA-N

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Source

Species Genus Family Order Class Phylum Kingdom Domain

Properties Information

Molecule Weight: 122.12699999999997

TPSA？: 55.98

MolLogP？: 0.1804999999999999

Number of H-Donors: 1

Number of H-Acceptors: 2

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi
None Unchecked Inhibition None % 10.1021/acsmedchemlett.5b00373

Metabolism Information

AKRT ID Reaction Reaction Link ID
AKRT015804 N#Cc1ccncc1>>NC(=O)c1ccncc1 enzymemap_84519
AKRT017298 NC(=O)c1ccncc1>>O=C(O)c1ccncc1 None