4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide

C11H9FN2O3S — CID 6324059

IUPAC4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide
SMILESO=c1[nH]cccc1NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C11H9FN2O3S/c12-8-3-5-9(6-4-8)18(16,17)14-10-2-1-7-13-11(10)15/h1-7,14H,(H,13,15)
InChIKeyXJFTYNDQVNSKGZ-UHFFFAOYSA-N
MW268.27 g/mol
LogP1.31
Rot. Bonds3

About 4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide

4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide (PubChem CID 6324059) has the molecular formula C11H9FN2O3S and a molecular weight of 268.27 g/mol. Its IUPAC name is 4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide
PubChem CID6324059
Molecular FormulaC11H9FN2O3S
Molecular Weight268.27 g/mol
Exact Mass268.03
IUPAC Name4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide
SMILESO=c1[nH]cccc1NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C11H9FN2O3S/c12-8-3-5-9(6-4-8)18(16,17)14-10-2-1-7-13-11(10)15/h1-7,14H,(H,13,15)
InChIKeyXJFTYNDQVNSKGZ-UHFFFAOYSA-N
XLogP1.31
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 51.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide?
The IUPAC name of 4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide (CID 6324059) is 4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide.
What is the SMILES notation for 4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide?
The canonical SMILES for 4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide is O=c1[nH]cccc1NS(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide?
The InChIKey is XJFTYNDQVNSKGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O3S/c12-8-3-5-9(6-4-8)18(16,17)14-10-2-1-7-13-11(10)15/h1-7,14H,(H,13,15).
What are the key properties of 4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide?
4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide has a molecular weight of 268.27 g/mol, XLogP of 1.31, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide is sourced from PubChem (CID 6324059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).