chempirical

1-Methyl-1H-benzimidazol-6-amine

C8H9N3CAS 26530-93-8147.18 g/mol

Open in Covalent MOL file
NNNH2
Primary amine

Properties

Molecular formula
C8H9N3
Molar mass
147.18 g/mol
Exact mass
147.0796 Da
logP
1.16Crippen estimate
Polar surface area
43.8 Ų
H-bond donors / acceptors
1 / 2
Rotatable bonds
0

Identifiers

CAS number
26530-93-8
SMILES
CN1C=NC2=C1C=C(C=C2)N
InChIKey
AYZALFCBEKQGRT-UHFFFAOYSA-N
InChI
InChI=1S/C8H9N3/c1-11-5-10-7-3-2-6(9)4-8(7)11/h2-5H,9H2,1H3

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Names and synonyms

1 names
  • 1H-Benzimidazol-6-amine,1-methyl-(9ci)

Work with 1-Methyl-1H-benzimidazol-6-amine

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

1-Methylbenzimidazole1632-83-353 % similar 1-Methyl-1H-indol-5-amine102308-97-444 % similar 5-Benzothiazolamine1123-93-938 % similar 1,3-Benzoxazol-6-amine177492-52-338 % similar 6-Benzothiazolamine533-30-238 % similar 6-Aminoquinoline580-15-438 % similar 5-Aminobenzimidazole934-22-538 % similar 2,3-Dimethyl-2H-indazol-6-amine444731-72-037 % similar

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

Same formula

1-Methyl-1H-benzimidazol-2-amine1622-57-7 5-(Aminomethyl)-1H-indazole267413-25-2 5,6-Dimethyl-1H-benzotriazole4184-79-6 1-Methyl-1H-indazol-6-amine74728-65-7 3-Methyl-1H-indazol-5-amine90764-90-2

Elsewhere

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