N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine

C15H21N3 — CID 115143924

IUPACN-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine
SMILESCN(CCC1CCCC1)c1nc2ccccc2[nH]1
InChIInChI=1S/C15H21N3/c1-18(11-10-12-6-2-3-7-12)15-16-13-8-4-5-9-14(13)17-15/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,16,17)
InChIKeyZYPAGWUFFWXCON-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.58
Rot. Bonds4

About N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine

N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine (PubChem CID 115143924) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine.

Molecular Properties

Compound NameN-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine
PubChem CID115143924
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine
SMILESCN(CCC1CCCC1)c1nc2ccccc2[nH]1
InChIInChI=1S/C15H21N3/c1-18(11-10-12-6-2-3-7-12)15-16-13-8-4-5-9-14(13)17-15/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,16,17)
InChIKeyZYPAGWUFFWXCON-UHFFFAOYSA-N
XLogP3.58
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-butyl-N-methyl-1H-benzimidazol-2-amine
CID 71723451
N-methyl-N-(piperidin-4-ylmethyl)-1H-benzimidazol-2-amine;hydrochloride
CID 71642448
N-(2-methoxyethyl)-N-methyl-1H-benzimidazol-2-amine
CID 133409792
N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine
CID 115143834
5-[1H-benzimidazol-2-yl(methyl)amino]pentan-1-ol
CID 107203344
N-(2-cyclopropylethyl)-N-methyl-1,3-benzothiazol-2-amine
CID 133398444
N,N-dimethyl-1H-benzimidazol-2-amine
CID 17846
N-(2-chloropropyl)-N-methyl-1H-benzimidazol-2-amine
CID 63392162
2-(6-cyclohexylhexyl)-1H-benzimidazole
CID 141189799
N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine
CID 90287555
CID 101039162
CID 101039162
N-(2-cyclopropylethyl)-N-methylquinolin-2-amine
CID 133398513

Frequently Asked Questions

What is the IUPAC name of N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine?
The IUPAC name of N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine (CID 115143924) is N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine.
What is the SMILES notation for N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine?
The canonical SMILES for N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine is CN(CCC1CCCC1)c1nc2ccccc2[nH]1.
What is the InChIKey of N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine?
The InChIKey is ZYPAGWUFFWXCON-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-18(11-10-12-6-2-3-7-12)15-16-13-8-4-5-9-14(13)17-15/h4-5,8-9,12H,2-3,6-7,10-11H2,1H3,(H,16,17).
What are the key properties of N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine?
N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine has a molecular weight of 243.35 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-cyclopentylethyl)-N-methyl-1H-benzimidazol-2-amine is sourced from PubChem (CID 115143924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).