1.0 2016-06-03 12:15:56 UTC 2026-08-19 05:01:21 UTC 4-amino-N-[4-(aminocarbonyl)phenyl]benzamide SmallMolecule 4-amino-N-[4-(aminocarbonyl)phenyl]benzamide is an organic compound with the formula C14H13N3O2 and an average molecular weight of 255.28 g/mol. 4-amino-N-[4-(aminocarbonyl)phenyl]benzamide belongs to the anilides, a subclass of benzene and substituted derivatives within the organic compounds. This benzenoid compound has been identified in one recorded source: drinking water and water supply (drinking water). The recorded route of exposure for this substance is oral. C14H13N3O2 255.277 255.100776671 4-amino-N-(4-carbamoylphenyl)benzene-1-carboximidic acid 4-amino-N-(4-carbamoylphenyl)benzenecarboximidic acid 74441-06-8 NC(=O)C1=CC=C(C=C1)N=C(O)C1=CC=C(N)C=C1 InChI=1S/C14H13N3O2/c15-11-5-1-10(2-6-11)14(19)17-12-7-3-9(4-8-12)13(16)18/h1-8H,15H2,(H2,16,18)(H,17,19) FSPYMSUDIVFOHY-UHFFFAOYSA-N Organic compounds Benzenoids Benzene and substituted derivatives Anilides Benzanilides Amino acids and derivatives Aminobenzoic acids and derivatives Aniline and substituted anilines Benzamides Benzoyl derivatives Hydrocarbon derivatives Organic oxides Organooxygen compounds Organopnictogen compounds Primary amines Primary carboxylic acid amides Secondary carboxylic acid amides Amine Amino acid or derivatives Aminobenzoic acid or derivatives Aniline or substituted anilines Aromatic homomonocyclic compound Benzamide Benzanilide Benzoic acid or derivatives Benzoyl Carboxamide group Carboxylic acid derivative Hydrocarbon derivative Organic nitrogen compound Organic oxide Organic oxygen compound Organonitrogen compound Organooxygen compound Organopnictogen compound Primary amine Primary carboxylic acid amide Secondary carboxylic acid amide Aromatic homomonocyclic compounds Detected and Not Quantified logp 0.8 logp 1.00 ALOGPS logs -3.30 ALOGPS solubility 1.27e-01 g/l ALOGPS logp 1.81 ChemAxon pka_strongest_acidic 6.8 ChemAxon pka_strongest_basic 3.27 ChemAxon iupac 4-amino-N-(4-carbamoylphenyl)benzene-1-carboximidic acid ChemAxon average_mass 255.277 ChemAxon mono_mass 255.100776671 ChemAxon smiles NC(=O)C1=CC=C(C=C1)N=C(O)C1=CC=C(N)C=C1 ChemAxon formula C14H13N3O2 ChemAxon inchi InChI=1S/C14H13N3O2/c15-11-5-1-10(2-6-11)14(19)17-12-7-3-9(4-8-12)13(16)18/h1-8H,15H2,(H2,16,18)(H,17,19) ChemAxon inchikey FSPYMSUDIVFOHY-UHFFFAOYSA-N ChemAxon polar_surface_area 101.7 ChemAxon refractivity 76.13 ChemAxon polarizability 27.11 ChemAxon rotatable_bond_count 3 ChemAxon acceptor_count 4 ChemAxon donor_count 3 ChemAxon physiological_charge 0 ChemAxon formal_charge 0 ChemAxon #<HealthEffect::ActiveRecord_Associations_CollectionProxy:0x00007f3bcfb55a10> 3018508 2286024