3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide

C11H7F3N2O2S — CID 113259712

IUPAC3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(F)nc1)c1cc(F)cc(F)c1
InChIInChI=1S/C11H7F3N2O2S/c12-7-3-8(13)5-10(4-7)19(17,18)16-9-1-2-11(14)15-6-9/h1-6,16H
InChIKeyLZHGOIDHKPLTJX-UHFFFAOYSA-N
MW288.25 g/mol
LogP2.30
Rot. Bonds3

About 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide

3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide (PubChem CID 113259712) has the molecular formula C11H7F3N2O2S and a molecular weight of 288.25 g/mol. Its IUPAC name is 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide.

Molecular Properties

Compound Name3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
PubChem CID113259712
Molecular FormulaC11H7F3N2O2S
Molecular Weight288.25 g/mol
Exact Mass288.02
IUPAC Name3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc(F)nc1)c1cc(F)cc(F)c1
InChIInChI=1S/C11H7F3N2O2S/c12-7-3-8(13)5-10(4-7)19(17,18)16-9-1-2-11(14)15-6-9/h1-6,16H
InChIKeyLZHGOIDHKPLTJX-UHFFFAOYSA-N
XLogP2.30
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.25
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide 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

N-(6-amino-3-pyridinyl)-3,5-difluorobenzenesulfonamide
CID 60791459
3,5-dichloro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 103775753
2-bromo-4,6-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 103775763
N-(6-fluoro-3-pyridinyl)-4-methoxybenzenesulfonamide
CID 103775697
2-chloro-5-fluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 113259716
4-[(6-fluoro-3-pyridinyl)sulfamoyl]benzamide
CID 103775704
3-fluoro-N-(6-fluoro-3-pyridinyl)-4-nitrobenzenesulfonamide
CID 103871850
3,5-difluoro-N-[4-(methylamino)phenyl]benzenesulfonamide
CID 43604154
3-acetyl-N-(6-fluoro-3-pyridinyl)benzenesulfonamide
CID 103775761
N-(5-bromo-6-chloro-3-pyridinyl)-3,5-difluorobenzenesulfonamide
CID 104826709
3,5-difluoro-N-[4-(trifluoromethyl)phenyl]benzenesulfonamide
CID 26970283
4-[(6-fluoro-3-pyridinyl)sulfamoyl]-1-methylpyrrole-2-carboxylic acid
CID 103777928

Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide?
The IUPAC name of 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide (CID 113259712) is 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide.
What is the SMILES notation for 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide?
The canonical SMILES for 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide is O=S(=O)(Nc1ccc(F)nc1)c1cc(F)cc(F)c1.
What is the InChIKey of 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide?
The InChIKey is LZHGOIDHKPLTJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7F3N2O2S/c12-7-3-8(13)5-10(4-7)19(17,18)16-9-1-2-11(14)15-6-9/h1-6,16H.
What are the key properties of 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide?
3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide has a molecular weight of 288.25 g/mol, XLogP of 2.30, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-(6-fluoro-3-pyridinyl)benzenesulfonamide is sourced from PubChem (CID 113259712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).