chempirical

2-(2-Aminophenyl)benzimidazole

C13H11N3CAS 5805-39-0209.25 g/mol

Open in Covalent MOL file
NH2NNH
Primary amine

Properties

Molecular formula
C13H11N3
Molar mass
209.25 g/mol
Exact mass
209.0953 Da
Melting point
213–214 °C
logP
2.81Crippen estimate
Polar surface area
54.7 Ų
H-bond donors / acceptors
2 / 2
Rotatable bonds
1

Identifiers

CAS number
5805-39-0
SMILES
Nc1ccccc1-c1nc2ccccc2[nH]1
InChIKey
YWNXHTNWOQHFRL-UHFFFAOYSA-N
InChI
InChI=1S/C13H11N3/c14-10-6-2-1-5-9(10)13-15-11-7-3-4-8-12(11)16-13/h1-8H,14H2,(H,15,16)

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Names and synonyms

11 names
  • Benzenamine, 2-(1H-benzimidazol-2-yl)-
  • Benzimidazole, 2-(o-aminophenyl)-
  • 2-(1H-Benzimidazol-2-yl)benzenamine
  • 2-(o-Aminophenyl)benzimidazole
  • G 620
  • G 620 (Amine)
  • 2-(2-Aminophenyl)-1H-benzimidazole
  • 2-[Benzimidazol-2-yl]benzenamine
  • 2-(1H-Benzimidazol-2-yl)aniline
  • 2-(1H-1,3-Benzodiazol-2-yl)aniline
  • 2-(1H-Benzoimidazol-2-yl)-phenylamine

Work with 2-(2-Aminophenyl)benzimidazole

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

Chlorfenazole3574-96-758 % similar 2-Phenylbenzimidazole716-79-052 % similar Mercaptobenzimidazole583-39-150 % similar 2-(2′-Pyridyl)benzimidazole1137-68-446 % similar 2-Chlorobenzimidazole4857-06-145 % similar 2-Methylbenzimidazole615-15-645 % similar 2-Benzimidazolinone615-16-745 % similar Fuberidazole3878-19-144 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Elsewhere

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