6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol

C11H18N2O — CID 79847286

IUPAC6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol
SMILESCC1(C)CCCC(n2ccnc2)C1O
InChIInChI=1S/C11H18N2O/c1-11(2)5-3-4-9(10(11)14)13-7-6-12-8-13/h6-10,14H,3-5H2,1-2H3
InChIKeyLBMXMHPUDVBIHA-UHFFFAOYSA-N
MW194.28 g/mol
LogP2.00
Rot. Bonds1

About 6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol

6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol (PubChem CID 79847286) has the molecular formula C11H18N2O and a molecular weight of 194.28 g/mol. Its IUPAC name is 6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol.

Molecular Properties

Compound Name6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol
PubChem CID79847286
Molecular FormulaC11H18N2O
Molecular Weight194.28 g/mol
Exact Mass194.14
IUPAC Name6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol
SMILESCC1(C)CCCC(n2ccnc2)C1O
InChIInChI=1S/C11H18N2O/c1-11(2)5-3-4-9(10(11)14)13-7-6-12-8-13/h6-10,14H,3-5H2,1-2H3
InChIKeyLBMXMHPUDVBIHA-UHFFFAOYSA-N
XLogP2.00
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.28
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol?
The IUPAC name of 6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol (CID 79847286) is 6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol.
What is the SMILES notation for 6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol?
The canonical SMILES for 6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol is CC1(C)CCCC(n2ccnc2)C1O.
What is the InChIKey of 6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol?
The InChIKey is LBMXMHPUDVBIHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O/c1-11(2)5-3-4-9(10(11)14)13-7-6-12-8-13/h6-10,14H,3-5H2,1-2H3.
What are the key properties of 6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol?
6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol has a molecular weight of 194.28 g/mol, XLogP of 2.00, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol is sourced from PubChem (CID 79847286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).