3-(furan-3-yl)cyclopentan-1-one

C9H10O2 — CID 64522121

IUPAC3-(furan-3-yl)cyclopentan-1-one
SMILESO=C1CCC(c2ccoc2)C1
InChIInChI=1S/C9H10O2/c10-9-2-1-7(5-9)8-3-4-11-6-8/h3-4,6-7H,1-2,5H2
InChIKeyQTNGALBLOFXWNQ-UHFFFAOYSA-N
MW150.18 g/mol
LogP2.12
Rot. Bonds1

About 3-(furan-3-yl)cyclopentan-1-one

3-(furan-3-yl)cyclopentan-1-one (PubChem CID 64522121) has the molecular formula C9H10O2 and a molecular weight of 150.18 g/mol. Its IUPAC name is 3-(furan-3-yl)cyclopentan-1-one.

Molecular Properties

Compound Name3-(furan-3-yl)cyclopentan-1-one
PubChem CID64522121
Molecular FormulaC9H10O2
Molecular Weight150.18 g/mol
Exact Mass150.07
IUPAC Name3-(furan-3-yl)cyclopentan-1-one
SMILESO=C1CCC(c2ccoc2)C1
InChIInChI=1S/C9H10O2/c10-9-2-1-7(5-9)8-3-4-11-6-8/h3-4,6-7H,1-2,5H2
InChIKeyQTNGALBLOFXWNQ-UHFFFAOYSA-N
XLogP2.12
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(furan-3-yl)cyclopentan-1-one?
The IUPAC name of 3-(furan-3-yl)cyclopentan-1-one (CID 64522121) is 3-(furan-3-yl)cyclopentan-1-one.
What is the SMILES notation for 3-(furan-3-yl)cyclopentan-1-one?
The canonical SMILES for 3-(furan-3-yl)cyclopentan-1-one is O=C1CCC(c2ccoc2)C1.
What is the InChIKey of 3-(furan-3-yl)cyclopentan-1-one?
The InChIKey is QTNGALBLOFXWNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10O2/c10-9-2-1-7(5-9)8-3-4-11-6-8/h3-4,6-7H,1-2,5H2.
What are the key properties of 3-(furan-3-yl)cyclopentan-1-one?
3-(furan-3-yl)cyclopentan-1-one has a molecular weight of 150.18 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(furan-3-yl)cyclopentan-1-one is sourced from PubChem (CID 64522121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).