chempirical

5-Amino-2-benzimidazolinone

C7H7N3OCAS 95-23-8149.15 g/mol

Open in Covalent MOL file
H2NNOHNH
PhenolPrimary amine

Properties

Molecular formula
C7H7N3O
Molar mass
149.15 g/mol
Exact mass
149.0589 Da
Melting point
above 300 °C
logP
0.85Crippen estimate
Polar surface area
74.9 Ų
H-bond donors / acceptors
3 / 3
Rotatable bonds
0

Identifiers

CAS number
95-23-8
SMILES
Nc1ccc2nc(O)[nH]c2c1
InChIKey
BCXSVFBDMPSKPT-UHFFFAOYSA-N
InChI
InChI=1S/C7H7N3O/c8-4-1-2-5-6(3-4)10-7(11)9-5/h1-3H,8H2,(H2,9,10,11)

Weigh it out

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

Names and synonyms

12 names
  • 2H-Benzimidazol-2-one, 5-amino-1,3-dihydro-
  • 2-Benzimidazolinone, 5-amino-
  • 5-Amino-1,3-dihydro-2H-benzimidazol-2-one
  • 5-Amino-2(3H)-benzimidazolone
  • 5-Amino-2-hydroxybenzimidazole
  • 2-Hydroxy-5-aminobenzimidazole
  • 5-Amino-2-oxo-2,3-dihydro-1H-benzimidazole
  • 5-Amino-1,3-dihydrobenzimidazol-2-one
  • 5-Amino-1H-benzo[d]imidazol-2(3H)-one
  • 5-Amino-1H-benzimidazol-2(3H)-one
  • 2-Oxo-2,3-dihydro-1H-benzimidazol-5-amine
  • 5-Amino-1,3-dihydro-2H-benzo[d]imidazol-2-one

Work with 5-Amino-2-benzimidazolinone

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

5-Amino-2-mercaptobenzimidazole2818-66-859 % similar 5,6-Diaminobenzimidazolone55621-49-358 % similar 5-Amino-2-(trifluoromethyl)benzimidazole3671-66-754 % similar 2-Benzimidazolinone615-16-753 % similar 5-Amino-1,3-dihydro-6-methyl-2H-benzimidazol-2-one67014-36-250 % similar 1,3-Dihydro-5-nitro-2H-benzimidazol-2-one93-84-550 % similar 5-Aminobenzimidazole934-22-546 % similar 2-(4-Aminophenyl)-5-aminobenzimidazole7621-86-543 % similar

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

Elsewhere

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