6-cyclopentyl-2-hydroxy-2H-pyran-5-one

C10H14O3 — CID 163210252

IUPAC6-cyclopentyl-2-hydroxy-2H-pyran-5-one
SMILESO=C1C=CC(O)OC1C1CCCC1
InChIInChI=1S/C10H14O3/c11-8-5-6-9(12)13-10(8)7-3-1-2-4-7/h5-7,9-10,12H,1-4H2
InChIKeyLFTWYZPAQXRXRG-UHFFFAOYSA-N
MW182.22 g/mol
LogP1.02
Rot. Bonds1

About 6-cyclopentyl-2-hydroxy-2H-pyran-5-one

6-cyclopentyl-2-hydroxy-2H-pyran-5-one (PubChem CID 163210252) has the molecular formula C10H14O3 and a molecular weight of 182.22 g/mol. Its IUPAC name is 6-cyclopentyl-2-hydroxy-2H-pyran-5-one.

Molecular Properties

Compound Name6-cyclopentyl-2-hydroxy-2H-pyran-5-one
PubChem CID163210252
Molecular FormulaC10H14O3
Molecular Weight182.22 g/mol
Exact Mass182.09
IUPAC Name6-cyclopentyl-2-hydroxy-2H-pyran-5-one
SMILESO=C1C=CC(O)OC1C1CCCC1
InChIInChI=1S/C10H14O3/c11-8-5-6-9(12)13-10(8)7-3-1-2-4-7/h5-7,9-10,12H,1-4H2
InChIKeyLFTWYZPAQXRXRG-UHFFFAOYSA-N
XLogP1.02
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 ≤ 51.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-cyclopentyl-2-hydroxy-2H-pyran-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 6-cyclopentyl-2-hydroxy-2H-pyran-5-one?
The IUPAC name of 6-cyclopentyl-2-hydroxy-2H-pyran-5-one (CID 163210252) is 6-cyclopentyl-2-hydroxy-2H-pyran-5-one.
What is the SMILES notation for 6-cyclopentyl-2-hydroxy-2H-pyran-5-one?
The canonical SMILES for 6-cyclopentyl-2-hydroxy-2H-pyran-5-one is O=C1C=CC(O)OC1C1CCCC1.
What is the InChIKey of 6-cyclopentyl-2-hydroxy-2H-pyran-5-one?
The InChIKey is LFTWYZPAQXRXRG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14O3/c11-8-5-6-9(12)13-10(8)7-3-1-2-4-7/h5-7,9-10,12H,1-4H2.
What are the key properties of 6-cyclopentyl-2-hydroxy-2H-pyran-5-one?
6-cyclopentyl-2-hydroxy-2H-pyran-5-one has a molecular weight of 182.22 g/mol, XLogP of 1.02, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclopentyl-2-hydroxy-2H-pyran-5-one is sourced from PubChem (CID 163210252), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).