N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide

C9H9FN4O4S2 — CID 102693891

IUPACN-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide
SMILESNS(=O)(=O)c1ccc(F)c(NS(=O)(=O)c2ccn[nH]2)c1
InChIInChI=1S/C9H9FN4O4S2/c10-7-2-1-6(19(11,15)16)5-8(7)14-20(17,18)9-3-4-12-13-9/h1-5,14H,(H,12,13)(H2,11,15,16)
InChIKeyTXPUCVIULNJYIQ-UHFFFAOYSA-N
MW320.33 g/mol
LogP-0.00
Rot. Bonds4

About N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide

N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide (PubChem CID 102693891) has the molecular formula C9H9FN4O4S2 and a molecular weight of 320.33 g/mol. Its IUPAC name is N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide.

Molecular Properties

Compound NameN-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide
PubChem CID102693891
Molecular FormulaC9H9FN4O4S2
Molecular Weight320.33 g/mol
Exact Mass320.00
IUPAC NameN-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide
SMILESNS(=O)(=O)c1ccc(F)c(NS(=O)(=O)c2ccn[nH]2)c1
InChIInChI=1S/C9H9FN4O4S2/c10-7-2-1-6(19(11,15)16)5-8(7)14-20(17,18)9-3-4-12-13-9/h1-5,14H,(H,12,13)(H2,11,15,16)
InChIKeyTXPUCVIULNJYIQ-UHFFFAOYSA-N
XLogP-0.00
TPSA135.01 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500320.33
LogP ≤ 5-0.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-fluorophenyl)-1H-pyrazole-5-sulfonamide
CID 102691575
N-(3-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide
CID 102693893
N-(2,3,5-trifluorophenyl)-1H-pyrazole-5-sulfonamide
CID 102692960
N-(3-fluoro-4-pyridinyl)-1H-pyrazole-5-sulfonamide
CID 107595249
N-(3,5-difluorophenyl)-1H-pyrazole-5-sulfonamide
CID 102691589
2-fluoro-5-(1H-pyrazol-5-ylsulfonylamino)benzamide
CID 102692467
N-(2-bromo-5-methyl-4-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide
CID 102691391
N-[3-(sulfamoylamino)phenyl]-1H-pyrazole-5-sulfonamide
CID 102692751
N-(5-chloro-2-methoxyphenyl)-1H-pyrazole-5-sulfonamide
CID 102691501
N-(6-amino-1,3-benzodioxol-5-yl)-1H-pyrazole-5-sulfonamide
CID 102690534
3-bromo-N'-hydroxy-4-(1H-pyrazol-5-ylsulfonylamino)benzenecarboximidamide
CID 107790817
methyl 2-fluoro-5-(1H-pyrazol-5-ylsulfonylamino)benzoate
CID 102691734

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide?
The IUPAC name of N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide (CID 102693891) is N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide.
What is the SMILES notation for N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide?
The canonical SMILES for N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide is NS(=O)(=O)c1ccc(F)c(NS(=O)(=O)c2ccn[nH]2)c1.
What is the InChIKey of N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide?
The InChIKey is TXPUCVIULNJYIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9FN4O4S2/c10-7-2-1-6(19(11,15)16)5-8(7)14-20(17,18)9-3-4-12-13-9/h1-5,14H,(H,12,13)(H2,11,15,16).
What are the key properties of N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide?
N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide has a molecular weight of 320.33 g/mol, XLogP of -0.00, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-sulfamoylphenyl)-1H-pyrazole-5-sulfonamide is sourced from PubChem (CID 102693891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).