2-(furan-3-yl)cyclopent-2-en-1-one

C9H8O2 — CID 86065514

IUPAC2-(furan-3-yl)cyclopent-2-en-1-one
SMILESO=C1CCC=C1c1ccoc1
InChIInChI=1S/C9H8O2/c10-9-3-1-2-8(9)7-4-5-11-6-7/h2,4-6H,1,3H2
InChIKeyAQEQDZOYGPOBQQ-UHFFFAOYSA-N
MW148.16 g/mol
LogP2.03
Rot. Bonds1

About 2-(furan-3-yl)cyclopent-2-en-1-one

2-(furan-3-yl)cyclopent-2-en-1-one (PubChem CID 86065514) has the molecular formula C9H8O2 and a molecular weight of 148.16 g/mol. Its IUPAC name is 2-(furan-3-yl)cyclopent-2-en-1-one.

Molecular Properties

Compound Name2-(furan-3-yl)cyclopent-2-en-1-one
PubChem CID86065514
Molecular FormulaC9H8O2
Molecular Weight148.16 g/mol
Exact Mass148.05
IUPAC Name2-(furan-3-yl)cyclopent-2-en-1-one
SMILESO=C1CCC=C1c1ccoc1
InChIInChI=1S/C9H8O2/c10-9-3-1-2-8(9)7-4-5-11-6-7/h2,4-6H,1,3H2
InChIKeyAQEQDZOYGPOBQQ-UHFFFAOYSA-N
XLogP2.03
TPSA30.21 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.16
LogP ≤ 52.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)cyclopent-2-en-1-one?
The IUPAC name of 2-(furan-3-yl)cyclopent-2-en-1-one (CID 86065514) is 2-(furan-3-yl)cyclopent-2-en-1-one.
What is the SMILES notation for 2-(furan-3-yl)cyclopent-2-en-1-one?
The canonical SMILES for 2-(furan-3-yl)cyclopent-2-en-1-one is O=C1CCC=C1c1ccoc1.
What is the InChIKey of 2-(furan-3-yl)cyclopent-2-en-1-one?
The InChIKey is AQEQDZOYGPOBQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8O2/c10-9-3-1-2-8(9)7-4-5-11-6-7/h2,4-6H,1,3H2.
What are the key properties of 2-(furan-3-yl)cyclopent-2-en-1-one?
2-(furan-3-yl)cyclopent-2-en-1-one has a molecular weight of 148.16 g/mol, XLogP of 2.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)cyclopent-2-en-1-one is sourced from PubChem (CID 86065514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).