5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine

C17H19N3 — CID 82359041

IUPAC5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine
SMILESCc1cc2nc(N)n(C(C)c3ccccc3)c2cc1C
InChIInChI=1S/C17H19N3/c1-11-9-15-16(10-12(11)2)20(17(18)19-15)13(3)14-7-5-4-6-8-14/h4-10,13H,1-3H3,(H2,18,19)
InChIKeyNONZEWAZQMESME-UHFFFAOYSA-N
MW265.36 g/mol
LogP3.84
Rot. Bonds2

About 5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine

5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine (PubChem CID 82359041) has the molecular formula C17H19N3 and a molecular weight of 265.36 g/mol. Its IUPAC name is 5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine.

Molecular Properties

Compound Name5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine
PubChem CID82359041
Molecular FormulaC17H19N3
Molecular Weight265.36 g/mol
Exact Mass265.16
IUPAC Name5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine
SMILESCc1cc2nc(N)n(C(C)c3ccccc3)c2cc1C
InChIInChI=1S/C17H19N3/c1-11-9-15-16(10-12(11)2)20(17(18)19-15)13(3)14-7-5-4-6-8-14/h4-10,13H,1-3H3,(H2,18,19)
InChIKeyNONZEWAZQMESME-UHFFFAOYSA-N
XLogP3.84
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 53.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-fluoro-1-[1-(3-fluorophenyl)ethyl]-6-methylbenzimidazol-2-amine
CID 103592825
5-methyl-3-(1-phenylethyl)imidazo[4,5-b]pyridin-2-amine
CID 81137999
3-(2-amino-5,6-dimethylbenzimidazol-1-yl)butan-2-one
CID 82359054
5-fluoro-6-methyl-1-(1-thiophen-2-ylethyl)benzimidazol-2-amine
CID 103592746
5-iodo-1-(1-pyridin-3-ylethyl)benzimidazol-2-amine
CID 66081984
4-chloro-1-(1-phenylethyl)benzimidazol-2-amine
CID 104836790
5-iodo-1-(1-phenylpropyl)benzimidazol-2-amine
CID 66081206
6-chloro-1-[1-(2-methylphenyl)ethyl]benzimidazol-2-amine
CID 115470510
4-methyl-1-(1-phenylethyl)pyrazol-5-amine
CID 43148081
2-ethyl-1-[(1R)-1-phenylethyl]benzimidazole
CID 962439
propyl 2-(2-amino-5,6-dimethylbenzimidazol-1-yl)propanoate
CID 82359019
1,5,6-trimethylbenzimidazol-2-amine;hydrochloride
CID 72710310

Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine?
The IUPAC name of 5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine (CID 82359041) is 5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine.
What is the SMILES notation for 5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine?
The canonical SMILES for 5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine is Cc1cc2nc(N)n(C(C)c3ccccc3)c2cc1C.
What is the InChIKey of 5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine?
The InChIKey is NONZEWAZQMESME-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3/c1-11-9-15-16(10-12(11)2)20(17(18)19-15)13(3)14-7-5-4-6-8-14/h4-10,13H,1-3H3,(H2,18,19).
What are the key properties of 5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine?
5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine has a molecular weight of 265.36 g/mol, XLogP of 3.84, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-1-(1-phenylethyl)benzimidazol-2-amine is sourced from PubChem (CID 82359041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).