2-(4-butylcyclohexyl)ethanol

C12H24O — CID 15085164

IUPAC2-(4-butylcyclohexyl)ethanol
SMILESCCCCC1CCC(CCO)CC1
InChIInChI=1S/C12H24O/c1-2-3-4-11-5-7-12(8-6-11)9-10-13/h11-13H,2-10H2,1H3
InChIKeyMLRIQUQGNCNMQB-UHFFFAOYSA-N
MW184.32 g/mol
LogP3.37
Rot. Bonds5

About 2-(4-butylcyclohexyl)ethanol

2-(4-butylcyclohexyl)ethanol (PubChem CID 15085164) has the molecular formula C12H24O and a molecular weight of 184.32 g/mol. Its IUPAC name is 2-(4-butylcyclohexyl)ethanol.

Molecular Properties

Compound Name2-(4-butylcyclohexyl)ethanol
PubChem CID15085164
Molecular FormulaC12H24O
Molecular Weight184.32 g/mol
Exact Mass184.18
IUPAC Name2-(4-butylcyclohexyl)ethanol
SMILESCCCCC1CCC(CCO)CC1
InChIInChI=1S/C12H24O/c1-2-3-4-11-5-7-12(8-6-11)9-10-13/h11-13H,2-10H2,1H3
InChIKeyMLRIQUQGNCNMQB-UHFFFAOYSA-N
XLogP3.37
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.32
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-(4-butylcyclohexyl)ethanol with MolForge

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

Launch Full Analysis

Related Compounds

[4-[2-(4-butylcyclohexyl)ethyl]cyclohexyl]methanol
CID 19899859
hexane;pentylcyclopropane
CID 159592467
1-butyl-4-ethylcyclohexane;methane
CID 145295190
1-butyl-4-(2-cyclopentylethyl)cyclohexane
CID 157379859
[4-[2-(4-pentylcyclohexyl)ethyl]cyclohexyl]methanol
CID 19899796
1,4-dihexylcyclohexane
CID 22947938
1-dodecyl-4-pentadecylcyclohexane
CID 123560684
octadecane;pentadecylcyclopropane
CID 173301851
tetradecane;undecylcyclopropane
CID 173215670
N-[(4-butylcyclohexyl)methyl]ethanamine
CID 43163710
azane;hexylcyclopropane
CID 135322230
2-[4-[[4-[[4-[(4-methylcyclohexyl)methyl]cyclohexyl]methyl]cyclohexyl]methyl]cyclohexyl]ethanol
CID 59931224

Frequently Asked Questions

What is the IUPAC name of 2-(4-butylcyclohexyl)ethanol?
The IUPAC name of 2-(4-butylcyclohexyl)ethanol (CID 15085164) is 2-(4-butylcyclohexyl)ethanol.
What is the SMILES notation for 2-(4-butylcyclohexyl)ethanol?
The canonical SMILES for 2-(4-butylcyclohexyl)ethanol is CCCCC1CCC(CCO)CC1.
What is the InChIKey of 2-(4-butylcyclohexyl)ethanol?
The InChIKey is MLRIQUQGNCNMQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O/c1-2-3-4-11-5-7-12(8-6-11)9-10-13/h11-13H,2-10H2,1H3.
What are the key properties of 2-(4-butylcyclohexyl)ethanol?
2-(4-butylcyclohexyl)ethanol has a molecular weight of 184.32 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-butylcyclohexyl)ethanol is sourced from PubChem (CID 15085164), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).