N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide

C11H9FN2O3S — CID 107595237

IUPACN-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide
SMILESO=S(=O)(Nc1ccncc1F)c1ccc(O)cc1
InChIInChI=1S/C11H9FN2O3S/c12-10-7-13-6-5-11(10)14-18(16,17)9-3-1-8(15)2-4-9/h1-7,15H,(H,13,14)
InChIKeyICUIYSYHLCGTSY-UHFFFAOYSA-N
MW268.27 g/mol
LogP1.73
Rot. Bonds3

About N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide

N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide (PubChem CID 107595237) has the molecular formula C11H9FN2O3S and a molecular weight of 268.27 g/mol. Its IUPAC name is N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide.

Molecular Properties

Compound NameN-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide
PubChem CID107595237
Molecular FormulaC11H9FN2O3S
Molecular Weight268.27 g/mol
Exact Mass268.03
IUPAC NameN-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide
SMILESO=S(=O)(Nc1ccncc1F)c1ccc(O)cc1
InChIInChI=1S/C11H9FN2O3S/c12-10-7-13-6-5-11(10)14-18(16,17)9-3-1-8(15)2-4-9/h1-7,15H,(H,13,14)
InChIKeyICUIYSYHLCGTSY-UHFFFAOYSA-N
XLogP1.73
TPSA79.29 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-acetyl-N-(3-fluoro-4-pyridinyl)benzenesulfonamide
CID 103862771
N-(3-fluoro-4-pyridinyl)-4-(3-hydroxyprop-1-ynyl)benzenesulfonamide
CID 107595353
N-(3-fluoro-4-pyridinyl)-4-(propylamino)benzenesulfonamide
CID 107595393
3-bromo-N-(3-fluoro-4-pyridinyl)benzenesulfonamide
CID 103943790
5-bromo-N-(3-fluoro-4-pyridinyl)pyridine-3-sulfonamide
CID 103943788
2-fluoro-N-(3-fluoro-4-pyridinyl)benzenesulfonamide
CID 113340997
3-amino-N-(3-fluoro-4-pyridinyl)-4-methoxybenzenesulfonamide
CID 107594685
3-(1-aminoethyl)-N-(3-fluoro-4-pyridinyl)benzenesulfonamide
CID 107595189
N-(3-fluoro-4-pyridinyl)-1H-pyrazole-5-sulfonamide
CID 107595249
N-(3-fluoro-4-pyridinyl)-3-(trifluoromethoxy)benzenesulfonamide
CID 122135835
N-(3-fluoro-4-pyridinyl)-2-methylbenzenesulfonamide
CID 103862773
1-bromo-N-(3-fluoro-4-pyridinyl)methanesulfonamide
CID 107595287

Frequently Asked Questions

What is the IUPAC name of N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide?
The IUPAC name of N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide (CID 107595237) is N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide.
What is the SMILES notation for N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide?
The canonical SMILES for N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide is O=S(=O)(Nc1ccncc1F)c1ccc(O)cc1.
What is the InChIKey of N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide?
The InChIKey is ICUIYSYHLCGTSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN2O3S/c12-10-7-13-6-5-11(10)14-18(16,17)9-3-1-8(15)2-4-9/h1-7,15H,(H,13,14).
What are the key properties of N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide?
N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide has a molecular weight of 268.27 g/mol, XLogP of 1.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluoro-4-pyridinyl)-4-hydroxybenzenesulfonamide is sourced from PubChem (CID 107595237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).