3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide

C10H9F2N3O2S — CID 25046115

IUPAC3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide
SMILESCn1nccc1NS(=O)(=O)c1ccc(F)c(F)c1
InChIInChI=1S/C10H9F2N3O2S/c1-15-10(4-5-13-15)14-18(16,17)7-2-3-8(11)9(12)6-7/h2-6,14H,1H3
InChIKeyVDZNFYCDXPRHKM-UHFFFAOYSA-N
MW273.26 g/mol
LogP1.50
Rot. Bonds3

About 3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide

3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide (PubChem CID 25046115) has the molecular formula C10H9F2N3O2S and a molecular weight of 273.26 g/mol. Its IUPAC name is 3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide.

Molecular Properties

Compound Name3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide
PubChem CID25046115
Molecular FormulaC10H9F2N3O2S
Molecular Weight273.26 g/mol
Exact Mass273.04
IUPAC Name3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide
SMILESCn1nccc1NS(=O)(=O)c1ccc(F)c(F)c1
InChIInChI=1S/C10H9F2N3O2S/c1-15-10(4-5-13-15)14-18(16,17)7-2-3-8(11)9(12)6-7/h2-6,14H,1H3
InChIKeyVDZNFYCDXPRHKM-UHFFFAOYSA-N
XLogP1.50
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.26
LogP ≤ 51.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-ethylpyrazol-3-yl)-3,4-difluorobenzenesulfonamide
CID 25039958
3,4-difluoro-N-[2-(6-methylpyridazin-3-yl)pyrazol-3-yl]benzenesulfonamide
CID 166225138
4-ethyl-N-(2-methylpyrazol-3-yl)benzenesulfonamide
CID 25048296
N-(2-methylpyrazol-3-yl)-4-(propylamino)benzenesulfonamide
CID 62157548
2-amino-5-bromo-4-fluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide
CID 106491675
3,4-difluoro-N-(1,2,4-triazol-4-yl)benzenesulfonamide
CID 19683362
N-(2,6-difluorophenyl)-3,4-difluorobenzenesulfonamide
CID 8500850
N-(3,4-difluorophenyl)-3,4-difluorobenzenesulfonamide
CID 7788321
N-(2-methylpyrazol-3-yl)-1-propan-2-ylpyrazole-4-sulfonamide
CID 139011594
3,4-difluoro-N-[4-(methylamino)phenyl]benzenesulfonamide
CID 43403537
5-[[(2R)-butan-2-yl]sulfamoyl]-2-fluoro-N-(2-methylpyrazol-3-yl)benzamide
CID 90259276
N-[4-[(3,4-difluorophenyl)sulfonylamino]phenyl]-1-methyl-6-oxopyridazine-3-carboxamide
CID 55349074

Frequently Asked Questions

What is the IUPAC name of 3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide?
The IUPAC name of 3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide (CID 25046115) is 3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide.
What is the SMILES notation for 3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide?
The canonical SMILES for 3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide is Cn1nccc1NS(=O)(=O)c1ccc(F)c(F)c1.
What is the InChIKey of 3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide?
The InChIKey is VDZNFYCDXPRHKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9F2N3O2S/c1-15-10(4-5-13-15)14-18(16,17)7-2-3-8(11)9(12)6-7/h2-6,14H,1H3.
What are the key properties of 3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide?
3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide has a molecular weight of 273.26 g/mol, XLogP of 1.50, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-difluoro-N-(2-methylpyrazol-3-yl)benzenesulfonamide is sourced from PubChem (CID 25046115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).