[1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine

C15H21N3 — CID 113309672

IUPAC[1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine
SMILESCn1c(C2(CN)CCCCC2)nc2ccccc21
InChIInChI=1S/C15H21N3/c1-18-13-8-4-3-7-12(13)17-14(18)15(11-16)9-5-2-6-10-15/h3-4,7-8H,2,5-6,9-11,16H2,1H3
InChIKeyRDMQJYKDGMXACX-UHFFFAOYSA-N
MW243.35 g/mol
LogP2.73
Rot. Bonds2

About [1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine

[1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine (PubChem CID 113309672) has the molecular formula C15H21N3 and a molecular weight of 243.35 g/mol. Its IUPAC name is [1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine.

Molecular Properties

Compound Name[1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine
PubChem CID113309672
Molecular FormulaC15H21N3
Molecular Weight243.35 g/mol
Exact Mass243.17
IUPAC Name[1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine
SMILESCn1c(C2(CN)CCCCC2)nc2ccccc21
InChIInChI=1S/C15H21N3/c1-18-13-8-4-3-7-12(13)17-14(18)15(11-16)9-5-2-6-10-15/h3-4,7-8H,2,5-6,9-11,16H2,1H3
InChIKeyRDMQJYKDGMXACX-UHFFFAOYSA-N
XLogP2.73
TPSA43.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.35
LogP ≤ 52.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(1-methylbenzimidazol-2-yl)cycloheptyl]methanamine
CID 115443651
[1-(1-methylbenzimidazol-2-yl)cyclobutyl]methanamine
CID 115445727
[4-methyl-1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine
CID 115441203
[1-(1-propylbenzimidazol-2-yl)cyclohexyl]methanamine
CID 115436209
[1-(1-methylimidazo[4,5-c]pyridin-2-yl)cycloheptyl]methanamine
CID 115443687
[1-(6-fluoro-1-methylbenzimidazol-2-yl)cyclohexyl]methanamine
CID 115436253
[1-(4-fluoro-1-methylbenzimidazol-2-yl)cyclopentyl]methanamine
CID 113309172
[1-(7-chloro-1-methylbenzimidazol-2-yl)cyclobutyl]methanamine
CID 113311165
[1-(5-chloro-1-methylbenzimidazol-2-yl)cyclopropyl]methanamine
CID 115450556
2-[1-(aminomethyl)cyclopropyl]-3-methylquinazolin-4-one
CID 84792832
[1-[1-(2-methoxyethyl)benzimidazol-2-yl]cyclopropyl]methanamine
CID 115450576
[1-(7-chloro-1-methylbenzimidazol-2-yl)cyclopropyl]methanamine
CID 115450565

Frequently Asked Questions

What is the IUPAC name of [1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine?
The IUPAC name of [1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine (CID 113309672) is [1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine.
What is the SMILES notation for [1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine?
The canonical SMILES for [1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine is Cn1c(C2(CN)CCCCC2)nc2ccccc21.
What is the InChIKey of [1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine?
The InChIKey is RDMQJYKDGMXACX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3/c1-18-13-8-4-3-7-12(13)17-14(18)15(11-16)9-5-2-6-10-15/h3-4,7-8H,2,5-6,9-11,16H2,1H3.
What are the key properties of [1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine?
[1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine has a molecular weight of 243.35 g/mol, XLogP of 2.73, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(1-methylbenzimidazol-2-yl)cyclohexyl]methanamine is sourced from PubChem (CID 113309672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).