4-cyclohexyl-3-hydroxy-2H-furan-5-one

C10H14O3 — CID 54676473

IUPAC4-cyclohexyl-3-hydroxy-2H-furan-5-one
SMILESO=C1OCC(O)=C1C1CCCCC1
InChIInChI=1S/C10H14O3/c11-8-6-13-10(12)9(8)7-4-2-1-3-5-7/h7,11H,1-6H2
InChIKeyUOHNVACTBABRQJ-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.94
Rot. Bonds1

About 4-cyclohexyl-3-hydroxy-2H-furan-5-one

4-cyclohexyl-3-hydroxy-2H-furan-5-one (PubChem CID 54676473) has the molecular formula C10H14O3 and a molecular weight of 182.22 g/mol. Its IUPAC name is 4-cyclohexyl-3-hydroxy-2H-furan-5-one.

Molecular Properties

Compound Name4-cyclohexyl-3-hydroxy-2H-furan-5-one
PubChem CID54676473
Molecular FormulaC10H14O3
Molecular Weight182.22 g/mol
Exact Mass182.09
IUPAC Name4-cyclohexyl-3-hydroxy-2H-furan-5-one
SMILESO=C1OCC(O)=C1C1CCCCC1
InChIInChI=1S/C10H14O3/c11-8-6-13-10(12)9(8)7-4-2-1-3-5-7/h7,11H,1-6H2
InChIKeyUOHNVACTBABRQJ-UHFFFAOYSA-N
XLogP1.94
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.22
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 4-cyclohexyl-3-hydroxy-2H-furan-5-one 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 4-cyclohexyl-3-hydroxy-2H-furan-5-one?
The IUPAC name of 4-cyclohexyl-3-hydroxy-2H-furan-5-one (CID 54676473) is 4-cyclohexyl-3-hydroxy-2H-furan-5-one.
What is the SMILES notation for 4-cyclohexyl-3-hydroxy-2H-furan-5-one?
The canonical SMILES for 4-cyclohexyl-3-hydroxy-2H-furan-5-one is O=C1OCC(O)=C1C1CCCCC1.
What is the InChIKey of 4-cyclohexyl-3-hydroxy-2H-furan-5-one?
The InChIKey is UOHNVACTBABRQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O3/c11-8-6-13-10(12)9(8)7-4-2-1-3-5-7/h7,11H,1-6H2.
What are the key properties of 4-cyclohexyl-3-hydroxy-2H-furan-5-one?
4-cyclohexyl-3-hydroxy-2H-furan-5-one has a molecular weight of 182.22 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclohexyl-3-hydroxy-2H-furan-5-one is sourced from PubChem (CID 54676473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).