5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide

C9H7F2N3O2S — CID 61395273

IUPAC5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide
SMILESNS(=O)(=O)c1cn[nH]c1-c1c(F)cccc1F
InChIInChI=1S/C9H7F2N3O2S/c10-5-2-1-3-6(11)8(5)9-7(4-13-14-9)17(12,15)16/h1-4H,(H,13,14)(H2,12,15,16)
InChIKeyZLOFCMUWDNGEKE-UHFFFAOYSA-N
MW259.24 g/mol
LogP1.00
Rot. Bonds2

About 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide

5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide (PubChem CID 61395273) has the molecular formula C9H7F2N3O2S and a molecular weight of 259.24 g/mol. Its IUPAC name is 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound Name5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide
PubChem CID61395273
Molecular FormulaC9H7F2N3O2S
Molecular Weight259.24 g/mol
Exact Mass259.02
IUPAC Name5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide
SMILESNS(=O)(=O)c1cn[nH]c1-c1c(F)cccc1F
InChIInChI=1S/C9H7F2N3O2S/c10-5-2-1-3-6(11)8(5)9-7(4-13-14-9)17(12,15)16/h1-4H,(H,13,14)(H2,12,15,16)
InChIKeyZLOFCMUWDNGEKE-UHFFFAOYSA-N
XLogP1.00
TPSA88.84 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.24
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide (CID 61395273) is 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide is NS(=O)(=O)c1cn[nH]c1-c1c(F)cccc1F.
What is the InChIKey of 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is ZLOFCMUWDNGEKE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7F2N3O2S/c10-5-2-1-3-6(11)8(5)9-7(4-13-14-9)17(12,15)16/h1-4H,(H,13,14)(H2,12,15,16).
What are the key properties of 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide?
5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 259.24 g/mol, XLogP of 1.00, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2,6-difluorophenyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 61395273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).