cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol

C11H20O2 — CID 147689783

IUPACcis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol
SMILESO[C@@H]1CCCC[C@H]1C1CCOCC1
InChIInChI=1S/C11H20O2/c12-11-4-2-1-3-10(11)9-5-7-13-8-6-9/h9-12H,1-8H2/t10-,11+/m0/s1
InChIKeyGQSXCDAJYINAQJ-WDEREUQCSA-N
MW184.28 g/mol
LogP1.96
Rot. Bonds1

About cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol

cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol (PubChem CID 147689783) has the molecular formula C11H20O2 and a molecular weight of 184.28 g/mol. Its IUPAC name is cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol.

Molecular Properties

Compound Namecis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol
PubChem CID147689783
Molecular FormulaC11H20O2
Molecular Weight184.28 g/mol
Exact Mass184.15
IUPAC Namecis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol
SMILESO[C@@H]1CCCC[C@H]1C1CCOCC1
InChIInChI=1S/C11H20O2/c12-11-4-2-1-3-10(11)9-5-7-13-8-6-9/h9-12H,1-8H2/t10-,11+/m0/s1
InChIKeyGQSXCDAJYINAQJ-WDEREUQCSA-N
XLogP1.96
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol 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 cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol?
The IUPAC name of cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol (CID 147689783) is cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol.
What is the SMILES notation for cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol?
The canonical SMILES for cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol is O[C@@H]1CCCC[C@H]1C1CCOCC1.
What is the InChIKey of cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol?
The InChIKey is GQSXCDAJYINAQJ-WDEREUQCSA-N. The full InChI is InChI=1S/C11H20O2/c12-11-4-2-1-3-10(11)9-5-7-13-8-6-9/h9-12H,1-8H2/t10-,11+/m0/s1.
What are the key properties of cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol?
cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol has a molecular weight of 184.28 g/mol, XLogP of 1.96, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2S)-2-(oxan-4-yl)cyclohexan-1-ol is sourced from PubChem (CID 147689783), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).