5-cyclopropylidenefuran-2-one

C7H6O2 — CID 147169834

IUPAC5-cyclopropylidenefuran-2-one
SMILESO=C1C=CC(=C2CC2)O1
InChIInChI=1S/C7H6O2/c8-7-4-3-6(9-7)5-1-2-5/h3-4H,1-2H2
InChIKeyBXMWJSCJTSOQNV-UHFFFAOYSA-N
MW122.12 g/mol
LogP1.15
Rot. Bonds

About 5-cyclopropylidenefuran-2-one

5-cyclopropylidenefuran-2-one (PubChem CID 147169834) has the molecular formula C7H6O2 and a molecular weight of 122.12 g/mol. Its IUPAC name is 5-cyclopropylidenefuran-2-one.

Molecular Properties

Compound Name5-cyclopropylidenefuran-2-one
PubChem CID147169834
Molecular FormulaC7H6O2
Molecular Weight122.12 g/mol
Exact Mass122.04
IUPAC Name5-cyclopropylidenefuran-2-one
SMILESO=C1C=CC(=C2CC2)O1
InChIInChI=1S/C7H6O2/c8-7-4-3-6(9-7)5-1-2-5/h3-4H,1-2H2
InChIKeyBXMWJSCJTSOQNV-UHFFFAOYSA-N
XLogP1.15
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.12
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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(3E)-3-(5-oxofuran-2-ylidene)-1-benzofuran-2-one
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furan-2,5-dione;propan-2-one
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ethenylsilane;furan-2,5-dione
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furan-2,5-dione;tetrakis(prop-1-ene)
CID 90659509
CID 142761517
CID 142761517
(5Z)-5-(3-oxo-1-benzothiophen-2-ylidene)furan-2-one
CID 50901765
furan-2,5-dione;hexa-2,4-diene
CID 175511286
CID 139238708
CID 139238708
furan-2,5-dione;2-methyloxirane;oxirane
CID 170852253
1,6-dioxacyclotetracos-3-ene-2,5-dione
CID 154091712

Frequently Asked Questions

What is the IUPAC name of 5-cyclopropylidenefuran-2-one?
The IUPAC name of 5-cyclopropylidenefuran-2-one (CID 147169834) is 5-cyclopropylidenefuran-2-one.
What is the SMILES notation for 5-cyclopropylidenefuran-2-one?
The canonical SMILES for 5-cyclopropylidenefuran-2-one is O=C1C=CC(=C2CC2)O1.
What is the InChIKey of 5-cyclopropylidenefuran-2-one?
The InChIKey is BXMWJSCJTSOQNV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6O2/c8-7-4-3-6(9-7)5-1-2-5/h3-4H,1-2H2.
What are the key properties of 5-cyclopropylidenefuran-2-one?
5-cyclopropylidenefuran-2-one has a molecular weight of 122.12 g/mol, XLogP of 1.15, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropylidenefuran-2-one is sourced from PubChem (CID 147169834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).