4-Amino-N-[4-(aminocarbonyl)phenyl]benzamide

C₁₄H₁₃N₃O₂CAS 74441-06-8255.28 g/mol

Open in Covalent MOL file

Amide Primary amine

Properties

Molecular formula: C₁₄H₁₃N₃O₂
Molar mass: 255.28 g/mol
Exact mass: 255.1008 Da
logP: 2.00Crippen estimate
Polar surface area: 101.7 Å²
H-bond donors / acceptors: 3 / 3
Rotatable bonds: 3

Hazards

Warning

H315 Causes skin irritation16.7% of notifiers
H319 Causes serious eye irritation16.7% of notifiers

Aggregated from 6 ECHA notifications, via PubChem; a share says how many notifiers assign that statement.

Precautionary statements

P264, P264+P265, P280, P302+P352, P305+P351+P338, P321, P332+P317, P337+P317, P362+P364

Identifiers

CAS number

74441-06-8

SMILES

NC(=O)c1ccc(N=C(O)c2ccc(N)cc2)cc1

InChIKey

FSPYMSUDIVFOHY-UHFFFAOYSA-N

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)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

2 names

Benzamide, 4-amino-N-[4-(aminocarbonyl)phenyl]-
4-Amino-N-(4-(aminocarbonyl)phenyl)benzamide

Work with 4-Amino-N-[4-(aminocarbonyl)phenyl]benzamide

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

4,4'-Diaminobenzanilide785-30-877 % similar 4-Aminobenzamide2835-68-963 % similar 2-((4-Aminophenyl)amino)-2-oxoacetic acid103-92-447 % similar Terephthalamide3010-82-047 % similar 4-Aminobenzoic acid150-13-046 % similar 4-(Aminocarbonyl)benzoic acid6051-43-046 % similar N-(3-Aminophenyl)benzamide16091-26-244 % similar 4-Aminoacetanilide122-80-543 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue.

All similar compounds

Elsewhere

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