1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one

C11H10FNO3S — CID 139048110

IUPAC1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one
SMILESC=C1CCC(=O)N1S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C11H10FNO3S/c1-8-2-7-11(14)13(8)17(15,16)10-5-3-9(12)4-6-10/h3-6H,1-2,7H2
InChIKeyOWYRSSORPJXGPO-UHFFFAOYSA-N
MW255.27 g/mol
LogP1.65
Rot. Bonds2

About 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one

1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one (PubChem CID 139048110) has the molecular formula C11H10FNO3S and a molecular weight of 255.27 g/mol. Its IUPAC name is 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one.

Molecular Properties

Compound Name1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one
PubChem CID139048110
Molecular FormulaC11H10FNO3S
Molecular Weight255.27 g/mol
Exact Mass255.04
IUPAC Name1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one
SMILESC=C1CCC(=O)N1S(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C11H10FNO3S/c1-8-2-7-11(14)13(8)17(15,16)10-5-3-9(12)4-6-10/h3-6H,1-2,7H2
InChIKeyOWYRSSORPJXGPO-UHFFFAOYSA-N
XLogP1.65
TPSA54.45 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-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

1-[(4-Fluorophenyl)sulfonyl]-2-pyrrolidinone
CID 3161862
1-(Phenylsulfonyl)-2-pyrrolidinone
CID 667602
2,5-Pyrrolidinedione, 1-(phenylsulfonyl)-
CID 555214
1-(4-Fluorophenyl)sulfanylpyrrolidine-2,5-dione
CID 14103050
(2,5-Dioxopyrrolidin-1-yl) 4-fluorobenzenesulfonate
CID 21930767
1-(4-Fluorobenzenesulfonyl)-5-methyl-2-pyrrolidinone
CID 22725383
N-buta-1,3-dien-2-yl-N-(4-fluorophenyl)sulfonylacetamide
CID 123303145
1-(2-Fluorophenyl)sulfanylpyrrolidine-2,5-dione
CID 142466856
5-Methylidene-1-(4-methylphenyl)sulfonylpyrrolidin-2-one
CID 122377607
1-(2-Fluorophenyl)sulfonylpyrrolidin-2-one
CID 61216561
1-(4-Fluorophenyl)sulfonyl-4-methylpyrrolidin-2-one
CID 63100968
1-(2-Fluorophenyl)sulfonyl-4-methylpyrrolidin-2-one
CID 63101049

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one?
The IUPAC name of 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one (CID 139048110) is 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one.
What is the SMILES notation for 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one?
The canonical SMILES for 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one is C=C1CCC(=O)N1S(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one?
The InChIKey is OWYRSSORPJXGPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10FNO3S/c1-8-2-7-11(14)13(8)17(15,16)10-5-3-9(12)4-6-10/h3-6H,1-2,7H2.
What are the key properties of 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one?
1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one has a molecular weight of 255.27 g/mol, XLogP of 1.65, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)sulfonyl-5-methylidenepyrrolidin-2-one is sourced from PubChem (CID 139048110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).