2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol

C16H22N2O — CID 79753321

IUPAC2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol
SMILESCC1CCCCC1(O)Cc1nc2ccccc2n1C
InChIInChI=1S/C16H22N2O/c1-12-7-5-6-10-16(12,19)11-15-17-13-8-3-4-9-14(13)18(15)2/h3-4,8-9,12,19H,5-7,10-11H2,1-2H3
InChIKeyNCCLOBKOBWZANF-UHFFFAOYSA-N
MW258.36 g/mol
LogP3.06
Rot. Bonds2

About 2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol

2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol (PubChem CID 79753321) has the molecular formula C16H22N2O and a molecular weight of 258.36 g/mol. Its IUPAC name is 2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol.

Molecular Properties

Compound Name2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol
PubChem CID79753321
Molecular FormulaC16H22N2O
Molecular Weight258.36 g/mol
Exact Mass258.17
IUPAC Name2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol
SMILESCC1CCCCC1(O)Cc1nc2ccccc2n1C
InChIInChI=1S/C16H22N2O/c1-12-7-5-6-10-16(12,19)11-15-17-13-8-3-4-9-14(13)18(15)2/h3-4,8-9,12,19H,5-7,10-11H2,1-2H3
InChIKeyNCCLOBKOBWZANF-UHFFFAOYSA-N
XLogP3.06
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.36
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[1-[(1-methylbenzimidazol-2-yl)methyl]cyclopentyl]acetic acid
CID 61070767
1-[(1-methylbenzimidazol-2-yl)methyl]cycloheptane-1-carboxylic acid
CID 43470977
3-methoxy-1-[(1-methylbenzimidazol-2-yl)methyl]cyclobutan-1-ol
CID 106823868
1-[(1-ethylbenzimidazol-2-yl)methyl]-2,3-dimethylcyclohexan-1-ol
CID 79755052
2-methyl-4-[(1-methylbenzimidazol-2-yl)methyl]oxan-4-ol
CID 79754404
3-[(1-methylbenzimidazol-2-yl)methyl]-1,1-dioxothiolan-3-ol
CID 79753747
4-[(1-methylbenzimidazol-2-yl)methyl]azepan-4-ol
CID 103982830
3-methyl-4-[(1-propylbenzimidazol-2-yl)methyl]piperidin-4-ol
CID 114501819
2-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol
CID 79750115
1-[1-hydroxy-2-(1-methylbenzimidazol-2-yl)ethyl]cycloheptan-1-ol
CID 103452132
1-cyclopentyl-2-(1-methylbenzimidazol-2-yl)ethanone
CID 79753927
4-[(1-methylbenzimidazol-2-yl)methyl]-1-propan-2-ylpiperidin-4-ol
CID 79754553

Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol?
The IUPAC name of 2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol (CID 79753321) is 2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol.
What is the SMILES notation for 2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol?
The canonical SMILES for 2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol is CC1CCCCC1(O)Cc1nc2ccccc2n1C.
What is the InChIKey of 2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol?
The InChIKey is NCCLOBKOBWZANF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O/c1-12-7-5-6-10-16(12,19)11-15-17-13-8-3-4-9-14(13)18(15)2/h3-4,8-9,12,19H,5-7,10-11H2,1-2H3.
What are the key properties of 2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol?
2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol has a molecular weight of 258.36 g/mol, XLogP of 3.06, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-[(1-methylbenzimidazol-2-yl)methyl]cyclohexan-1-ol is sourced from PubChem (CID 79753321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).