[2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine

C17H25N3 — CID 65038299

IUPAC[2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine
SMILESCCn1c(CCC2CCCC2)nc2cc(CN)ccc21
InChIInChI=1S/C17H25N3/c1-2-20-16-9-7-14(12-18)11-15(16)19-17(20)10-8-13-5-3-4-6-13/h7,9,11,13H,2-6,8,10,12,18H2,1H3
InChIKeyQMAFQUOMBLEHMZ-UHFFFAOYSA-N
MW271.41 g/mol
LogP3.64
Rot. Bonds5

About [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine

[2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine (PubChem CID 65038299) has the molecular formula C17H25N3 and a molecular weight of 271.41 g/mol. Its IUPAC name is [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine.

Molecular Properties

Compound Name[2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine
PubChem CID65038299
Molecular FormulaC17H25N3
Molecular Weight271.41 g/mol
Exact Mass271.20
IUPAC Name[2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine
SMILESCCn1c(CCC2CCCC2)nc2cc(CN)ccc21
InChIInChI=1S/C17H25N3/c1-2-20-16-9-7-14(12-18)11-15(16)19-17(20)10-8-13-5-3-4-6-13/h7,9,11,13H,2-6,8,10,12,18H2,1H3
InChIKeyQMAFQUOMBLEHMZ-UHFFFAOYSA-N
XLogP3.64
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.41
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[2-[5-(aminomethyl)-1-ethylbenzimidazol-2-yl]ethyl]-N-methylcyclobutanamine
CID 70865779
[1-ethyl-2-(oxolan-2-ylmethyl)benzimidazol-5-yl]methanamine
CID 65159867
2-(1,5-diethylbenzimidazol-2-yl)ethanamine
CID 82333476
5-bromo-1-ethyl-2-(2-piperidin-2-ylethyl)benzimidazole
CID 62218072
[1-ethyl-2-(1-methylcyclohexyl)benzimidazol-5-yl]methanamine
CID 106829194
[2-(2,5-dimethylpyrazol-3-yl)-1-ethylbenzimidazol-5-yl]methanamine
CID 66127163
[2-(cyclobutylmethyl)-3-methylbenzimidazol-5-yl]methanamine
CID 103167106
1-ethyl-2-[2-(oxolan-2-yl)ethyl]benzimidazole-5-carbonitrile
CID 65159499
(1-cyclopropyl-2-pentylbenzimidazol-5-yl)methanamine
CID 65037611
4-[5-(aminomethyl)-1-propylbenzimidazol-2-yl]butan-1-ol
CID 79199391
5-(aminomethyl)-1-ethylbenzimidazole-2-carboxylic acid
CID 84786621
[1-ethyl-2-(3-methylbutan-2-yl)benzimidazol-5-yl]methanamine
CID 65038202

Frequently Asked Questions

What is the IUPAC name of [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine?
The IUPAC name of [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine (CID 65038299) is [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine.
What is the SMILES notation for [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine?
The canonical SMILES for [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine is CCn1c(CCC2CCCC2)nc2cc(CN)ccc21.
What is the InChIKey of [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine?
The InChIKey is QMAFQUOMBLEHMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3/c1-2-20-16-9-7-14(12-18)11-15(16)19-17(20)10-8-13-5-3-4-6-13/h7,9,11,13H,2-6,8,10,12,18H2,1H3.
What are the key properties of [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine?
[2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine has a molecular weight of 271.41 g/mol, XLogP of 3.64, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-cyclopentylethyl)-1-ethylbenzimidazol-5-yl]methanamine is sourced from PubChem (CID 65038299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).