1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol

C11H18N2O — CID 59088177

IUPAC1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol
SMILESCC1CCC(O)(Cn2ccnc2)CC1
InChIInChI=1S/C11H18N2O/c1-10-2-4-11(14,5-3-10)8-13-7-6-12-9-13/h6-7,9-10,14H,2-5,8H2,1H3
InChIKeyUSESGUFSBVJGSR-UHFFFAOYSA-N
MW194.28 g/mol
LogP1.82
Rot. Bonds2

About 1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol

1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol (PubChem CID 59088177) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol
PubChem CID59088177
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol
SMILESCC1CCC(O)(Cn2ccnc2)CC1
InChIInChI=1S/C11H18N2O/c1-10-2-4-11(14,5-3-10)8-13-7-6-12-9-13/h6-7,9-10,14H,2-5,8H2,1H3
InChIKeyUSESGUFSBVJGSR-UHFFFAOYSA-N
XLogP1.82
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Cyclohexyl-(1-methylimidazol-2-yl)methanol
CID 13331154
1-(1-Pentylimidazol-2-yl)cyclohexan-1-ol
CID 102490462
(1-Butylimidazol-2-yl)-cyclohexylmethanol
CID 102490465
3-(1-Cyclohexylimidazol-2-yl)pentan-3-ol
CID 102490470
1-(1-Methyl-1H-imidazol-2-yl)cyclohexan-1-ol
CID 49962356
1-Imidazol-1-yldodecan-2-ol
CID 317475
trans-(1S,2S)-2-(3-butylimidazol-3-ium-1-yl)cyclohexan-1-ol
CID 102090193
3-(1-Pentylimidazol-2-yl)pentan-3-ol
CID 102490460
Dicyclopropyl-(1-pentylimidazol-2-yl)methanol
CID 102490461
1-[[[1-(Difluoromethyl)imidazol-2-yl]methylamino]methyl]-3-methylcyclohexan-1-ol
CID 64686538
1-[[[1-(Difluoromethyl)imidazol-2-yl]methylamino]methyl]cyclohexan-1-ol
CID 64688952
1-(1-Methylimidazol-2-yl)-4-(trifluoromethyl)cyclohexan-1-ol
CID 64756316

Frequently Asked Questions

What is the IUPAC name of 1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol?
The IUPAC name of 1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol (CID 59088177) is 1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol.
What is the SMILES notation for 1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol?
The canonical SMILES for 1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol is CC1CCC(O)(Cn2ccnc2)CC1.
What is the InChIKey of 1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol?
The InChIKey is USESGUFSBVJGSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-10-2-4-11(14,5-3-10)8-13-7-6-12-9-13/h6-7,9-10,14H,2-5,8H2,1H3.
What are the key properties of 1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol?
1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol has a molecular weight of 194.28 g/mol, XLogP of 1.82, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(imidazol-1-ylmethyl)-4-methylcyclohexan-1-ol is sourced from PubChem (CID 59088177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).