N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide

C12H9F2NO3S — CID 81258697

IUPACN-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide
SMILESO=S(=O)(Nc1cc(F)ccc1F)c1cccc(O)c1
InChIInChI=1S/C12H9F2NO3S/c13-8-4-5-11(14)12(6-8)15-19(17,18)10-3-1-2-9(16)7-10/h1-7,15-16H
InChIKeyPVJZLZBNWUBKLD-UHFFFAOYSA-N
MW285.27 g/mol
LogP2.47
Rot. Bonds3

About N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide

N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide (PubChem CID 81258697) has the molecular formula C12H9F2NO3S and a molecular weight of 285.27 g/mol. Its IUPAC name is N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide.

Molecular Properties

Compound NameN-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide
PubChem CID81258697
Molecular FormulaC12H9F2NO3S
Molecular Weight285.27 g/mol
Exact Mass285.03
IUPAC NameN-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide
SMILESO=S(=O)(Nc1cc(F)ccc1F)c1cccc(O)c1
InChIInChI=1S/C12H9F2NO3S/c13-8-4-5-11(14)12(6-8)15-19(17,18)10-3-1-2-9(16)7-10/h1-7,15-16H
InChIKeyPVJZLZBNWUBKLD-UHFFFAOYSA-N
XLogP2.47
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.27
LogP ≤ 52.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2,5-difluorophenyl)-3-fluorobenzenesulfonamide
CID 8500597
3-chloro-N-(2,5-difluorophenyl)benzenesulfonamide
CID 8500608
N-(2-fluoro-4-methylphenyl)-3-hydroxybenzenesulfonamide
CID 81258256
N-(2,5-difluorophenyl)naphthalene-2-sulfonamide
CID 22773480
4-amino-N-(2,5-difluorophenyl)benzenesulfonamide
CID 2730891
2-chloro-N-(2,5-difluorophenyl)pyridine-4-sulfonamide
CID 54895626
3-cyano-N-(5-fluoro-2-hydroxyphenyl)benzenesulfonamide
CID 64794952
N-[2-(benzenesulfonamido)-4-fluorophenyl]benzenesulfonamide
CID 70139608
N-(2,5-difluorophenyl)-2,3-dihydro-1,4-benzodioxine-6-sulfonamide
CID 8500598
N-(2-amino-5-fluorophenyl)-3-methylbenzenesulfonamide
CID 63258167
N-(5-chloro-2-fluorophenyl)-2,5-difluorobenzenesulfonamide
CID 9238961
5-[(2,5-difluorophenyl)sulfamoyl]-2-methoxybenzoic acid
CID 56812265

Frequently Asked Questions

What is the IUPAC name of N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide?
The IUPAC name of N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide (CID 81258697) is N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide.
What is the SMILES notation for N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide?
The canonical SMILES for N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide is O=S(=O)(Nc1cc(F)ccc1F)c1cccc(O)c1.
What is the InChIKey of N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide?
The InChIKey is PVJZLZBNWUBKLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H9F2NO3S/c13-8-4-5-11(14)12(6-8)15-19(17,18)10-3-1-2-9(16)7-10/h1-7,15-16H.
What are the key properties of N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide?
N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide has a molecular weight of 285.27 g/mol, XLogP of 2.47, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-difluorophenyl)-3-hydroxybenzenesulfonamide is sourced from PubChem (CID 81258697), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).