chempirical

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

C14H13N3O2CAS 74441-06-8255.28 g/mol

Open in Covalent MOL file
H2NONHOH2N
AmidePrimary 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 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
3

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

1 names
  • Benzamide, 4-amino-N-[4-(aminocarbonyl)phenyl]-

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

PubChem CAS Common Chemistry NIST WebBook