2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol

C14H24N2O — CID 79847201

IUPAC2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol
SMILESCCCc1nccn1C1CCCC(C)(C)C1O
InChIInChI=1S/C14H24N2O/c1-4-6-12-15-9-10-16(12)11-7-5-8-14(2,3)13(11)17/h9-11,13,17H,4-8H2,1-3H3
InChIKeyWDBTWHZJVMBOPI-UHFFFAOYSA-N
MW236.36 g/mol
LogP2.95
Rot. Bonds3

About 2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol

2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol (PubChem CID 79847201) has the molecular formula C14H24N2O and a molecular weight of 236.36 g/mol. Its IUPAC name is 2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol
PubChem CID79847201
Molecular FormulaC14H24N2O
Molecular Weight236.36 g/mol
Exact Mass236.19
IUPAC Name2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol
SMILESCCCc1nccn1C1CCCC(C)(C)C1O
InChIInChI=1S/C14H24N2O/c1-4-6-12-15-9-10-16(12)11-7-5-8-14(2,3)13(11)17/h9-11,13,17H,4-8H2,1-3H3
InChIKeyWDBTWHZJVMBOPI-UHFFFAOYSA-N
XLogP2.95
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.36
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

trans-(1S,2S)-2-(2-propylimidazol-1-yl)cyclopentan-1-ol
CID 102735175
4-tert-butyl-3-(2-propylimidazol-1-yl)cyclohexan-1-ol
CID 165491999
4-(2-methylbutan-2-yl)-3-(2-propylimidazol-1-yl)cyclohexan-1-ol
CID 165491573
1-(cyclopropylamino)-3-(2-propylimidazol-1-yl)cyclohexane-1-carboxylic acid
CID 79634409
1-(ethylamino)-3-(2-propylimidazol-1-yl)cyclohexane-1-carbonitrile
CID 79625295
[1-(methylamino)-3-(2-propylimidazol-1-yl)cyclopentyl]methanol
CID 79644477
6-imidazol-1-yl-2,2-dimethylcyclohexan-1-ol
CID 79847286
N-ethyl-3-(2-propylimidazol-1-yl)cyclohexan-1-amine
CID 79619406
1-(ethylamino)-3-(2-propylimidazol-1-yl)cyclopentane-1-carboxylic acid
CID 79648637
N-ethyl-2,2-dimethyl-6-(2-propan-2-ylimidazol-1-yl)cyclohexan-1-amine
CID 79828969
1-(propylamino)-3-(2-propylimidazol-1-yl)cyclopentane-1-carbonitrile
CID 79638335
2-(2-ethylimidazol-1-yl)cyclopentan-1-amine
CID 61405200

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol?
The IUPAC name of 2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol (CID 79847201) is 2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol.
What is the SMILES notation for 2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol?
The canonical SMILES for 2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol is CCCc1nccn1C1CCCC(C)(C)C1O.
What is the InChIKey of 2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol?
The InChIKey is WDBTWHZJVMBOPI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O/c1-4-6-12-15-9-10-16(12)11-7-5-8-14(2,3)13(11)17/h9-11,13,17H,4-8H2,1-3H3.
What are the key properties of 2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol?
2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol has a molecular weight of 236.36 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-6-(2-propylimidazol-1-yl)cyclohexan-1-ol is sourced from PubChem (CID 79847201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).