1-[(3E)-4-Cyclopentylbut-3-en-2-yl]pyrrolidin-2-one
Basic information
- CAS
157832-83-2- Standard SMILES
CC(/C=C/C1CCCC1)N1CCCC1=O- InChIKey
FUGQYMYNMBSILA-CMDGGOBGSA-N- Molecular formula
- C13H21NO
- Average molar mass
- 207.31 g/mol
- Monoisotopic mass
- 207.16231429
Names & identifiers
- Preferred name
- 1-[(3E)-4-Cyclopentylbut-3-en-2-yl]pyrrolidin-2-one
- IUPAC
- 1-[(E)-4-cyclopentylbut-3-en-2-yl]pyrrolidin-2-one
Names & synonyms
DTXSID7011816461-[(3E)-4-Cyclopentylbut-3-en-2-yl]pyrrolidin-2-one2-Pyrrolidinone, 1-(3-cyclopentyl-1-methyl-2-propenyl)-, (E)-157832-83-2
Database identifiers
- CAS
157832-83-2- PubChem CID
- 165352467
- DTXSID
DTXSID701181646
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 20.3 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 3
- Heavy atoms
- 15
- Formal charge
- 0
- Complexity
- 253
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Compound notes
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