2-cyclopentyloxy-2H-furan-5-one

C9H12O3 — CID 22445978

IUPAC2-cyclopentyloxy-2H-furan-5-one
SMILESO=C1C=CC(OC2CCCC2)O1
InChIInChI=1S/C9H12O3/c10-8-5-6-9(12-8)11-7-3-1-2-4-7/h5-7,9H,1-4H2
InChIKeyWGZRLZHSMRICRW-UHFFFAOYSA-N
MW168.19 g/mol
LogP1.38
Rot. Bonds2

About 2-cyclopentyloxy-2H-furan-5-one

2-cyclopentyloxy-2H-furan-5-one (PubChem CID 22445978) has the molecular formula C9H12O3 and a molecular weight of 168.19 g/mol. Its IUPAC name is 2-cyclopentyloxy-2H-furan-5-one.

Molecular Properties

Compound Name2-cyclopentyloxy-2H-furan-5-one
PubChem CID22445978
Molecular FormulaC9H12O3
Molecular Weight168.19 g/mol
Exact Mass168.08
IUPAC Name2-cyclopentyloxy-2H-furan-5-one
SMILESO=C1C=CC(OC2CCCC2)O1
InChIInChI=1S/C9H12O3/c10-8-5-6-9(12-8)11-7-3-1-2-4-7/h5-7,9H,1-4H2
InChIKeyWGZRLZHSMRICRW-UHFFFAOYSA-N
XLogP1.38
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500168.19
LogP ≤ 51.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-2H-furan-5-one?
The IUPAC name of 2-cyclopentyloxy-2H-furan-5-one (CID 22445978) is 2-cyclopentyloxy-2H-furan-5-one.
What is the SMILES notation for 2-cyclopentyloxy-2H-furan-5-one?
The canonical SMILES for 2-cyclopentyloxy-2H-furan-5-one is O=C1C=CC(OC2CCCC2)O1.
What is the InChIKey of 2-cyclopentyloxy-2H-furan-5-one?
The InChIKey is WGZRLZHSMRICRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O3/c10-8-5-6-9(12-8)11-7-3-1-2-4-7/h5-7,9H,1-4H2.
What are the key properties of 2-cyclopentyloxy-2H-furan-5-one?
2-cyclopentyloxy-2H-furan-5-one has a molecular weight of 168.19 g/mol, XLogP of 1.38, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-2H-furan-5-one is sourced from PubChem (CID 22445978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).