3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide

C11H8F2N2O3S — CID 51101021

IUPAC3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide
SMILESO=c1[nH]cccc1NS(=O)(=O)c1cc(F)cc(F)c1
InChIInChI=1S/C11H8F2N2O3S/c12-7-4-8(13)6-9(5-7)19(17,18)15-10-2-1-3-14-11(10)16/h1-6,15H,(H,14,16)
InChIKeyGYDGHVBBJNMYEL-UHFFFAOYSA-N
MW286.26 g/mol
LogP1.45
Rot. Bonds3

About 3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide

3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide (PubChem CID 51101021) has the molecular formula C11H8F2N2O3S and a molecular weight of 286.26 g/mol. Its IUPAC name is 3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide
PubChem CID51101021
Molecular FormulaC11H8F2N2O3S
Molecular Weight286.26 g/mol
Exact Mass286.02
IUPAC Name3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide
SMILESO=c1[nH]cccc1NS(=O)(=O)c1cc(F)cc(F)c1
InChIInChI=1S/C11H8F2N2O3S/c12-7-4-8(13)6-9(5-7)19(17,18)15-10-2-1-3-14-11(10)16/h1-6,15H,(H,14,16)
InChIKeyGYDGHVBBJNMYEL-UHFFFAOYSA-N
XLogP1.45
TPSA79.03 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.26
LogP ≤ 51.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide?
The IUPAC name of 3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide (CID 51101021) is 3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide.
What is the SMILES notation for 3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide?
The canonical SMILES for 3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide is O=c1[nH]cccc1NS(=O)(=O)c1cc(F)cc(F)c1.
What is the InChIKey of 3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide?
The InChIKey is GYDGHVBBJNMYEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8F2N2O3S/c12-7-4-8(13)6-9(5-7)19(17,18)15-10-2-1-3-14-11(10)16/h1-6,15H,(H,14,16).
What are the key properties of 3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide?
3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide has a molecular weight of 286.26 g/mol, XLogP of 1.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-(2-oxo-1H-pyridin-3-yl)benzenesulfonamide is sourced from PubChem (CID 51101021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).