N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine

C15H21N3 — CID 65046013

IUPACN-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine
SMILESCC(NC1CCCC1C)c1nc2ccccc2[nH]1
InChIInChI=1S/C15H21N3/c1-10-6-5-9-12(10)16-11(2)15-17-13-7-3-4-8-14(13)18-15/h3-4,7-8,10-12,16H,5-6,9H2,1-2H3,(H,17,18)
InChIKeyYEJBMNVEGZOZFY-UHFFFAOYSA-N
MW243.35 g/mol
LogP3.40
Rot. Bonds3

About N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine

N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine (PubChem CID 65046013) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine.

Molecular Properties

Compound NameN-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine
PubChem CID65046013
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine
SMILESCC(NC1CCCC1C)c1nc2ccccc2[nH]1
InChIInChI=1S/C15H21N3/c1-10-6-5-9-12(10)16-11(2)15-17-13-7-3-4-8-14(13)18-15/h3-4,7-8,10-12,16H,5-6,9H2,1-2H3,(H,17,18)
InChIKeyYEJBMNVEGZOZFY-UHFFFAOYSA-N
XLogP3.40
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 53.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[1-(1H-benzimidazol-2-yl)ethyl]cyclohexanamine
CID 53410318
N-[1-(1H-benzimidazol-2-yl)ethyl]-2,2-dimethylcyclohexan-1-amine
CID 79836434
N-[1-(1H-benzimidazol-2-yl)ethyl]-4-ethylcyclohexan-1-amine
CID 60664261
1-(1H-benzimidazol-2-yl)-N-(cyclohexylmethyl)ethanamine
CID 60665119
N-[1-(1H-benzimidazol-2-yl)ethyl]-4,5,6,7-tetrahydro-1-benzofuran-4-amine
CID 115466482
N-[1-(1H-benzimidazol-2-yl)ethyl]-3-methyloxolane-2-carboxamide
CID 81449437
2-propan-2-yl-1H-benzimidazole
CID 22121
1-[1-(1H-benzimidazol-2-yl)ethyl]-3-propan-2-ylurea
CID 23548549
1-(1H-benzimidazol-2-yl)-N-(oxan-4-ylmethyl)ethanamine
CID 62673724
N-[1-(1H-benzimidazol-2-yl)ethyl]acetamide
CID 3149717
4-[1-(1H-benzimidazol-2-yl)ethylcarbamoyl]cyclohexane-1-carboxylic acid
CID 120672761
(1S)-1-(1H-benzimidazol-2-yl)ethanol
CID 139074850

Frequently Asked Questions

What is the IUPAC name of N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine?
The IUPAC name of N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine (CID 65046013) is N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine.
What is the SMILES notation for N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine?
The canonical SMILES for N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine is CC(NC1CCCC1C)c1nc2ccccc2[nH]1.
What is the InChIKey of N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine?
The InChIKey is YEJBMNVEGZOZFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-10-6-5-9-12(10)16-11(2)15-17-13-7-3-4-8-14(13)18-15/h3-4,7-8,10-12,16H,5-6,9H2,1-2H3,(H,17,18).
What are the key properties of N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine?
N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine has a molecular weight of 243.35 g/mol, XLogP of 3.40, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(1H-benzimidazol-2-yl)ethyl]-2-methylcyclopentan-1-amine is sourced from PubChem (CID 65046013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).