N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine

C15H21N3 — CID 82336914

IUPACN-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine
SMILESCc1ccc2nc(CCNC3CCCC3)[nH]c2c1
InChIInChI=1S/C15H21N3/c1-11-6-7-13-14(10-11)18-15(17-13)8-9-16-12-4-2-3-5-12/h6-7,10,12,16H,2-5,8-9H2,1H3,(H,17,18)
InChIKeyHLBKVXJWTHEKOF-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.95
Rot. Bonds4

About N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine

N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine (PubChem CID 82336914) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine.

Molecular Properties

Compound NameN-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine
PubChem CID82336914
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC NameN-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine
SMILESCc1ccc2nc(CCNC3CCCC3)[nH]c2c1
InChIInChI=1S/C15H21N3/c1-11-6-7-13-14(10-11)18-15(17-13)8-9-16-12-4-2-3-5-12/h6-7,10,12,16H,2-5,8-9H2,1H3,(H,17,18)
InChIKeyHLBKVXJWTHEKOF-UHFFFAOYSA-N
XLogP2.95
TPSA40.71 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclooctanamine
CID 82336932
N-[2-(6-ethyl-1H-benzimidazol-2-yl)ethyl]cycloheptanamine
CID 82336949
N-[2-(6-fluoro-1H-benzimidazol-2-yl)ethyl]cycloheptanamine
CID 82336950
N-[2-(6-fluoro-1H-benzimidazol-2-yl)ethyl]cyclooctanamine
CID 82336934
2-(cyclohexylmethyl)-6-methyl-1H-benzimidazole
CID 10082509
6-methyl-2-(pyrrolidin-2-ylmethyl)-1H-benzimidazole
CID 61371342
2-(6-methyl-1H-benzimidazol-2-yl)ethanamine;dihydrochloride
CID 19195701
N-[3-[(6-methyl-1H-benzimidazol-2-yl)sulfanyl]propyl]cyclopropanamine
CID 62876454
N,N-dimethyl-2-(6-methyl-1H-benzimidazol-2-yl)ethanamine
CID 45040735
N-[4-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]phenyl]cyclohexanecarboxamide
CID 46290730
4-cyclopentyl-N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]-3-oxopiperazine-1-carboxamide
CID 122564123
2-(3-hydroxypiperidin-1-yl)-N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]acetamide
CID 118787936

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine?
The IUPAC name of N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine (CID 82336914) is N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine.
What is the SMILES notation for N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine?
The canonical SMILES for N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine is Cc1ccc2nc(CCNC3CCCC3)[nH]c2c1.
What is the InChIKey of N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine?
The InChIKey is HLBKVXJWTHEKOF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-11-6-7-13-14(10-11)18-15(17-13)8-9-16-12-4-2-3-5-12/h6-7,10,12,16H,2-5,8-9H2,1H3,(H,17,18).
What are the key properties of N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine?
N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine has a molecular weight of 243.35 g/mol, XLogP of 2.95, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-methyl-1H-benzimidazol-2-yl)ethyl]cyclopentanamine is sourced from PubChem (CID 82336914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).