5-cyclopentylideneoxolan-2-one

C9H12O2 — CID 11804957

IUPAC5-cyclopentylideneoxolan-2-one
SMILESO=C1CCC(=C2CCCC2)O1
InChIInChI=1S/C9H12O2/c10-9-6-5-8(11-9)7-3-1-2-4-7/h1-6H2
InChIKeySWTIWYFEFZKCTL-UHFFFAOYSA-N
MW152.19 g/mol
LogP2.15
Rot. Bonds

About 5-cyclopentylideneoxolan-2-one

5-cyclopentylideneoxolan-2-one (PubChem CID 11804957) has the molecular formula C9H12O2 and a molecular weight of 152.19 g/mol. Its IUPAC name is 5-cyclopentylideneoxolan-2-one.

Molecular Properties

Compound Name5-cyclopentylideneoxolan-2-one
PubChem CID11804957
Molecular FormulaC9H12O2
Molecular Weight152.19 g/mol
Exact Mass152.08
IUPAC Name5-cyclopentylideneoxolan-2-one
SMILESO=C1CCC(=C2CCCC2)O1
InChIInChI=1S/C9H12O2/c10-9-6-5-8(11-9)7-3-1-2-4-7/h1-6H2
InChIKeySWTIWYFEFZKCTL-UHFFFAOYSA-N
XLogP2.15
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.19
LogP ≤ 52.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopentylideneoxolan-2-one?
The IUPAC name of 5-cyclopentylideneoxolan-2-one (CID 11804957) is 5-cyclopentylideneoxolan-2-one.
What is the SMILES notation for 5-cyclopentylideneoxolan-2-one?
The canonical SMILES for 5-cyclopentylideneoxolan-2-one is O=C1CCC(=C2CCCC2)O1.
What is the InChIKey of 5-cyclopentylideneoxolan-2-one?
The InChIKey is SWTIWYFEFZKCTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12O2/c10-9-6-5-8(11-9)7-3-1-2-4-7/h1-6H2.
What are the key properties of 5-cyclopentylideneoxolan-2-one?
5-cyclopentylideneoxolan-2-one has a molecular weight of 152.19 g/mol, XLogP of 2.15, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentylideneoxolan-2-one is sourced from PubChem (CID 11804957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).