4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide

C10H10FN3O2S — CID 112691515

IUPAC4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
SMILESCc1cn[nH]c1NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C10H10FN3O2S/c1-7-6-12-13-10(7)14-17(15,16)9-4-2-8(11)3-5-9/h2-6H,1H3,(H2,12,13,14)
InChIKeyPNQPSKUKHHVKEL-UHFFFAOYSA-N
MW255.27 g/mol
LogP1.66
Rot. Bonds3

About 4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide

4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide (PubChem CID 112691515) has the molecular formula C10H10FN3O2S and a molecular weight of 255.27 g/mol. Its IUPAC name is 4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
PubChem CID112691515
Molecular FormulaC10H10FN3O2S
Molecular Weight255.27 g/mol
Exact Mass255.05
IUPAC Name4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
SMILESCc1cn[nH]c1NS(=O)(=O)c1ccc(F)cc1
InChIInChI=1S/C10H10FN3O2S/c1-7-6-12-13-10(7)14-17(15,16)9-4-2-8(11)3-5-9/h2-6H,1H3,(H2,12,13,14)
InChIKeyPNQPSKUKHHVKEL-UHFFFAOYSA-N
XLogP1.66
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.27
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dimethyl-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 113237180
4-(bromomethyl)-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 113433906
methyl 4-[(4-methyl-1H-pyrazol-5-yl)sulfamoyl]benzoate
CID 115631180
4-bromo-3-methyl-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 113237166
2-amino-5-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 113433428
2,4,6-trifluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 112691498
4-(2-methoxyethoxy)-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 115631121
4-fluoro-N-(4-pyridin-4-yl-1H-pyrazol-5-yl)benzenesulfonamide
CID 20757672
3-amino-4-methoxy-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 104617179
3-chloro-4-methoxy-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 112691520
N-(4-bromo-1H-pyrazol-5-yl)-4-methylbenzenesulfonamide
CID 3852469
2-bromo-4,6-difluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 113237176

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide?
The IUPAC name of 4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide (CID 112691515) is 4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide.
What is the SMILES notation for 4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide?
The canonical SMILES for 4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide is Cc1cn[nH]c1NS(=O)(=O)c1ccc(F)cc1.
What is the InChIKey of 4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide?
The InChIKey is PNQPSKUKHHVKEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10FN3O2S/c1-7-6-12-13-10(7)14-17(15,16)9-4-2-8(11)3-5-9/h2-6H,1H3,(H2,12,13,14).
What are the key properties of 4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide?
4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide has a molecular weight of 255.27 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-(4-methyl-1H-pyrazol-5-yl)benzenesulfonamide is sourced from PubChem (CID 112691515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).