5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide

C15H14FN3O2S2 — CID 3873158

IUPAC5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide
SMILESCc1ccc(F)cc1S(=O)(=O)Nc1cc(-c2cccs2)nn1C
InChIInChI=1S/C15H14FN3O2S2/c1-10-5-6-11(16)8-14(10)23(20,21)18-15-9-12(17-19(15)2)13-4-3-7-22-13/h3-9,18H,1-2H3
InChIKeyIQAKTTXTYUBUNL-UHFFFAOYSA-N
MW351.43 g/mol
LogP3.40
Rot. Bonds4

About 5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide

5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide (PubChem CID 3873158) has the molecular formula C15H14FN3O2S2 and a molecular weight of 351.43 g/mol. Its IUPAC name is 5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide.

Molecular Properties

Compound Name5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide
PubChem CID3873158
Molecular FormulaC15H14FN3O2S2
Molecular Weight351.43 g/mol
Exact Mass351.05
IUPAC Name5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide
SMILESCc1ccc(F)cc1S(=O)(=O)Nc1cc(-c2cccs2)nn1C
InChIInChI=1S/C15H14FN3O2S2/c1-10-5-6-11(16)8-14(10)23(20,21)18-15-9-12(17-19(15)2)13-4-3-7-22-13/h3-9,18H,1-2H3
InChIKeyIQAKTTXTYUBUNL-UHFFFAOYSA-N
XLogP3.40
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.43
LogP ≤ 53.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide 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-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide?
The IUPAC name of 5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide (CID 3873158) is 5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide.
What is the SMILES notation for 5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide?
The canonical SMILES for 5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide is Cc1ccc(F)cc1S(=O)(=O)Nc1cc(-c2cccs2)nn1C.
What is the InChIKey of 5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide?
The InChIKey is IQAKTTXTYUBUNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O2S2/c1-10-5-6-11(16)8-14(10)23(20,21)18-15-9-12(17-19(15)2)13-4-3-7-22-13/h3-9,18H,1-2H3.
What are the key properties of 5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide?
5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide has a molecular weight of 351.43 g/mol, XLogP of 3.40, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-2-methyl-N-(1-methyl-3-thiophen-2-ylpyrazol-5-yl)benzenesulfonamide is sourced from PubChem (CID 3873158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).