4-(1-fluoroethenyl)pyrrolidin-2-one

C6H8FNO — CID 174682071

IUPAC4-(1-fluoroethenyl)pyrrolidin-2-one
SMILESC=C(F)C1CNC(=O)C1
InChIInChI=1S/C6H8FNO/c1-4(7)5-2-6(9)8-3-5/h5H,1-3H2,(H,8,9)
InChIKeyXEJHGVRDTWORCB-UHFFFAOYSA-N
MW129.13 g/mol
LogP0.61
Rot. Bonds1

About 4-(1-fluoroethenyl)pyrrolidin-2-one

4-(1-fluoroethenyl)pyrrolidin-2-one (PubChem CID 174682071) has the molecular formula C6H8FNO and a molecular weight of 129.13 g/mol. Its IUPAC name is 4-(1-fluoroethenyl)pyrrolidin-2-one.

Molecular Properties

Compound Name4-(1-fluoroethenyl)pyrrolidin-2-one
PubChem CID174682071
Molecular FormulaC6H8FNO
Molecular Weight129.13 g/mol
Exact Mass129.06
IUPAC Name4-(1-fluoroethenyl)pyrrolidin-2-one
SMILESC=C(F)C1CNC(=O)C1
InChIInChI=1S/C6H8FNO/c1-4(7)5-2-6(9)8-3-5/h5H,1-3H2,(H,8,9)
InChIKeyXEJHGVRDTWORCB-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

Analyze 4-(1-fluoroethenyl)pyrrolidin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Vinyl pyrrolidone
CID 12905136
3-Allylpyrrolidin-2-one
CID 13839124
(S)-4-(2,2-difluoro-vinyl)-pyrrolidin-2-one
CID 16059241
4-(2,2-Difluorovinyl)pyrrolidin-2-one
CID 17948959
(4R)-4-(2,2-Difluoroethenyl)pyrrolidin-2-one
CID 58019144
4-(Fluoromethyl)pyrrolidin-2-one
CID 67254655
3-(Fluoromethyl)pyrrolidin-2-one
CID 67255663
(4S)-4-[(Z)-1,2-difluoroethenyl]pyrrolidin-2-one
CID 69032535
(4S)-4-(1,2-difluoroethenyl)pyrrolidin-2-one
CID 69032536
(4R)-4-[(Z)-1,2-difluoroethenyl]pyrrolidin-2-one
CID 69033111
(4R)-4-(1,2-difluoroethenyl)pyrrolidin-2-one
CID 69033112
4-(1,2-Difluoroethenyl)pyrrolidin-2-one
CID 77592275

Frequently Asked Questions

What is the IUPAC name of 4-(1-fluoroethenyl)pyrrolidin-2-one?
The IUPAC name of 4-(1-fluoroethenyl)pyrrolidin-2-one (CID 174682071) is 4-(1-fluoroethenyl)pyrrolidin-2-one.
What is the SMILES notation for 4-(1-fluoroethenyl)pyrrolidin-2-one?
The canonical SMILES for 4-(1-fluoroethenyl)pyrrolidin-2-one is C=C(F)C1CNC(=O)C1.
What is the InChIKey of 4-(1-fluoroethenyl)pyrrolidin-2-one?
The InChIKey is XEJHGVRDTWORCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H8FNO/c1-4(7)5-2-6(9)8-3-5/h5H,1-3H2,(H,8,9).
What are the key properties of 4-(1-fluoroethenyl)pyrrolidin-2-one?
4-(1-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-(1-fluoroethenyl)pyrrolidin-2-one is sourced from PubChem (CID 174682071), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).