4-(2-fluoroethenyl)pyrrolidin-2-one

C6H8FNO — CID 123923302

IUPAC4-(2-fluoroethenyl)pyrrolidin-2-one
SMILESO=C1CC(C=CF)CN1
InChIInChI=1S/C6H8FNO/c7-2-1-5-3-6(9)8-4-5/h1-2,5H,3-4H2,(H,8,9)
InChIKeyZATNKAHMUQMCAC-UHFFFAOYSA-N
MW129.13 g/mol
LogP0.61
Rot. Bonds1

About 4-(2-fluoroethenyl)pyrrolidin-2-one

4-(2-fluoroethenyl)pyrrolidin-2-one (PubChem CID 123923302) has the molecular formula C6H8FNO and a molecular weight of 129.13 g/mol. Its IUPAC name is 4-(2-fluoroethenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-(2-fluoroethenyl)pyrrolidin-2-one
PubChem CID123923302
Molecular FormulaC6H8FNO
Molecular Weight129.13 g/mol
Exact Mass129.06
IUPAC Name4-(2-fluoroethenyl)pyrrolidin-2-one
SMILESO=C1CC(C=CF)CN1
InChIInChI=1S/C6H8FNO/c7-2-1-5-3-6(9)8-4-5/h1-2,5H,3-4H2,(H,8,9)
InChIKeyZATNKAHMUQMCAC-UHFFFAOYSA-N
XLogP0.61
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.13
LogP ≤ 50.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoroethenyl)pyrrolidin-2-one?
The IUPAC name of 4-(2-fluoroethenyl)pyrrolidin-2-one (CID 123923302) is 4-(2-fluoroethenyl)pyrrolidin-2-one.
What is the SMILES notation for 4-(2-fluoroethenyl)pyrrolidin-2-one?
The canonical SMILES for 4-(2-fluoroethenyl)pyrrolidin-2-one is O=C1CC(C=CF)CN1.
What is the InChIKey of 4-(2-fluoroethenyl)pyrrolidin-2-one?
The InChIKey is ZATNKAHMUQMCAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FNO/c7-2-1-5-3-6(9)8-4-5/h1-2,5H,3-4H2,(H,8,9).
What are the key properties of 4-(2-fluoroethenyl)pyrrolidin-2-one?
4-(2-fluoroethenyl)pyrrolidin-2-one has a molecular weight of 129.13 g/mol, XLogP of 0.61, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoroethenyl)pyrrolidin-2-one is sourced from PubChem (CID 123923302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).