1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol

C15H26N2O — CID 62718716

IUPAC1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol
SMILESCC(C)(C)C1CCC(C(O)Cc2ncc[nH]2)CC1
InChIInChI=1S/C15H26N2O/c1-15(2,3)12-6-4-11(5-7-12)13(18)10-14-16-8-9-17-14/h8-9,11-13,18H,4-7,10H2,1-3H3,(H,16,17)
InChIKeyJLMMLDLWLYPEJP-UHFFFAOYSA-N
MW250.39 g/mol
LogP3.17
Rot. Bonds3

About 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol

1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol (PubChem CID 62718716) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol
PubChem CID62718716
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Name1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol
SMILESCC(C)(C)C1CCC(C(O)Cc2ncc[nH]2)CC1
InChIInChI=1S/C15H26N2O/c1-15(2,3)12-6-4-11(5-7-12)13(18)10-14-16-8-9-17-14/h8-9,11-13,18H,4-7,10H2,1-3H3,(H,16,17)
InChIKeyJLMMLDLWLYPEJP-UHFFFAOYSA-N
XLogP3.17
TPSA48.91 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 53.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol?
The IUPAC name of 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol (CID 62718716) is 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol.
What is the SMILES notation for 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol?
The canonical SMILES for 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol is CC(C)(C)C1CCC(C(O)Cc2ncc[nH]2)CC1.
What is the InChIKey of 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol?
The InChIKey is JLMMLDLWLYPEJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O/c1-15(2,3)12-6-4-11(5-7-12)13(18)10-14-16-8-9-17-14/h8-9,11-13,18H,4-7,10H2,1-3H3,(H,16,17).
What are the key properties of 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol?
1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol has a molecular weight of 250.39 g/mol, XLogP of 3.17, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-tert-butylcyclohexyl)-2-(1H-imidazol-2-yl)ethanol is sourced from PubChem (CID 62718716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).