4-cyclohexyl-1-ethoxybutan-2-ol

C12H24O2 — CID 115818721

IUPAC4-cyclohexyl-1-ethoxybutan-2-ol
SMILESCCOCC(O)CCC1CCCCC1
InChIInChI=1S/C12H24O2/c1-2-14-10-12(13)9-8-11-6-4-3-5-7-11/h11-13H,2-10H2,1H3
InChIKeyUBJHSSGFIRBKMO-UHFFFAOYSA-N
MW200.32 g/mol
LogP2.74
Rot. Bonds6

About 4-cyclohexyl-1-ethoxybutan-2-ol

4-cyclohexyl-1-ethoxybutan-2-ol (PubChem CID 115818721) has the molecular formula C12H24O2 and a molecular weight of 200.32 g/mol. Its IUPAC name is 4-cyclohexyl-1-ethoxybutan-2-ol.

Molecular Properties

Compound Name4-cyclohexyl-1-ethoxybutan-2-ol
PubChem CID115818721
Molecular FormulaC12H24O2
Molecular Weight200.32 g/mol
Exact Mass200.18
IUPAC Name4-cyclohexyl-1-ethoxybutan-2-ol
SMILESCCOCC(O)CCC1CCCCC1
InChIInChI=1S/C12H24O2/c1-2-14-10-12(13)9-8-11-6-4-3-5-7-11/h11-13H,2-10H2,1H3
InChIKeyUBJHSSGFIRBKMO-UHFFFAOYSA-N
XLogP2.74
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.32
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-cyclohexyl-1-ethoxybutan-2-ol 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

2-(l-Menthoxy)ethanol
CID 10219851
2-tert-Butylcyclohexyloxybutanol
CID 164422
3-((2-Ethylhexyl)oxy)-1,2-propanediol
CID 9859093
Poly(oxy-1,2-ethanediyl), alpha-(3,5-dimethyl-1-(2-methylpropyl)hexyl)-omega-hydroxy-
CID 24982
3-((L-Menthyl)oxy)propane-1,2-diol
CID 6850757
3-(l-Menthoxy)-2-methylpropane-1,2-diol
CID 9834711
2-(Menthoxy)ethanol
CID 14064911
Menthoxypropanediol
CID 5362595
Cyclohexanol, 2-methoxy-4-propyl-
CID 91098
3-((2-Isopropyl-5-methylcyclohexyl)oxy)-2-methylpropane-1,2-diol
CID 16734862
(1-Methoxycyclohexyl)methanol
CID 21895925
(1-Methoxy-4-methylcyclohexyl)methanol
CID 123926231

Frequently Asked Questions

What is the IUPAC name of 4-cyclohexyl-1-ethoxybutan-2-ol?
The IUPAC name of 4-cyclohexyl-1-ethoxybutan-2-ol (CID 115818721) is 4-cyclohexyl-1-ethoxybutan-2-ol.
What is the SMILES notation for 4-cyclohexyl-1-ethoxybutan-2-ol?
The canonical SMILES for 4-cyclohexyl-1-ethoxybutan-2-ol is CCOCC(O)CCC1CCCCC1.
What is the InChIKey of 4-cyclohexyl-1-ethoxybutan-2-ol?
The InChIKey is UBJHSSGFIRBKMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24O2/c1-2-14-10-12(13)9-8-11-6-4-3-5-7-11/h11-13H,2-10H2,1H3.
What are the key properties of 4-cyclohexyl-1-ethoxybutan-2-ol?
4-cyclohexyl-1-ethoxybutan-2-ol has a molecular weight of 200.32 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-1-ethoxybutan-2-ol is sourced from PubChem (CID 115818721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).