2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide

C13H10FN3O2S — CID 2445035

IUPAC2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc2cn[nH]c2c1)c1ccccc1F
InChIInChI=1S/C13H10FN3O2S/c14-11-3-1-2-4-13(11)20(18,19)17-10-6-5-9-8-15-16-12(9)7-10/h1-8,17H,(H,15,16)
InChIKeyNABTVOZZKOYQRH-UHFFFAOYSA-N
MW291.31 g/mol
LogP2.50
Rot. Bonds3

About 2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide

2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide (PubChem CID 2445035) has the molecular formula C13H10FN3O2S and a molecular weight of 291.31 g/mol. Its IUPAC name is 2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide.

Molecular Properties

Compound Name2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide
PubChem CID2445035
Molecular FormulaC13H10FN3O2S
Molecular Weight291.31 g/mol
Exact Mass291.05
IUPAC Name2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide
SMILESO=S(=O)(Nc1ccc2cn[nH]c2c1)c1ccccc1F
InChIInChI=1S/C13H10FN3O2S/c14-11-3-1-2-4-13(11)20(18,19)17-10-6-5-9-8-15-16-12(9)7-10/h1-8,17H,(H,15,16)
InChIKeyNABTVOZZKOYQRH-UHFFFAOYSA-N
XLogP2.50
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.31
LogP ≤ 52.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1H-indazol-6-yl)-2-(trifluoromethyl)benzenesulfonamide
CID 2445030
2-fluoro-N-(1H-indol-6-yl)benzenesulfonamide
CID 71954733
N-(1H-indazol-6-yl)-5-methyl-1H-pyrazole-4-sulfonamide
CID 61276176
N-(1H-indazol-6-yl)-2,4-dimethylbenzenesulfonamide
CID 2078539
N-(1H-indazol-6-yl)sulfamoyl chloride
CID 84760699
N-(1H-indazol-6-yl)-2,4-dioxo-1H-pyrimidine-5-sulfonamide
CID 21008102
N-(1H-indazol-6-yl)-2-methoxy-4,5-dimethylbenzenesulfonamide
CID 110731214
5-chloro-N-(1H-indazol-6-yl)thiophene-2-sulfonamide
CID 2444866
2,5-dichloro-N-(1H-indazol-6-yl)-4-methoxybenzenesulfonamide
CID 2242342
N-(1H-indazol-6-yl)propane-2-sulfonamide
CID 25044387
4-chloro-3-(1H-indazol-6-ylsulfamoyl)benzoate
CID 7041976
N-(1H-indazol-6-yl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 97242161

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide?
The IUPAC name of 2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide (CID 2445035) is 2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide.
What is the SMILES notation for 2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide?
The canonical SMILES for 2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide is O=S(=O)(Nc1ccc2cn[nH]c2c1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide?
The InChIKey is NABTVOZZKOYQRH-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H10FN3O2S/c14-11-3-1-2-4-13(11)20(18,19)17-10-6-5-9-8-15-16-12(9)7-10/h1-8,17H,(H,15,16).
What are the key properties of 2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide?
2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide has a molecular weight of 291.31 g/mol, XLogP of 2.50, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(1H-indazol-6-yl)benzenesulfonamide is sourced from PubChem (CID 2445035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).