N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide

C15H14FN3O2S2 — CID 20947487

IUPACN-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide
SMILESCc1cc(-c2ccc(S(=O)(=O)Nc3ccc(F)cc3C)s2)n[nH]1
InChIInChI=1S/C15H14FN3O2S2/c1-9-7-11(16)3-4-12(9)19-23(20,21)15-6-5-14(22-15)13-8-10(2)17-18-13/h3-8,19H,1-2H3,(H,17,18)
InChIKeyHQQBMEMRGKOJRD-UHFFFAOYSA-N
MW351.43 g/mol
LogP3.69
Rot. Bonds4

About N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide

N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide (PubChem CID 20947487) has the molecular formula C15H14FN3O2S2 and a molecular weight of 351.43 g/mol. Its IUPAC name is N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide
PubChem CID20947487
Molecular FormulaC15H14FN3O2S2
Molecular Weight351.43 g/mol
Exact Mass351.05
IUPAC NameN-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide
SMILESCc1cc(-c2ccc(S(=O)(=O)Nc3ccc(F)cc3C)s2)n[nH]1
InChIInChI=1S/C15H14FN3O2S2/c1-9-7-11(16)3-4-12(9)19-23(20,21)15-6-5-14(22-15)13-8-10(2)17-18-13/h3-8,19H,1-2H3,(H,17,18)
InChIKeyHQQBMEMRGKOJRD-UHFFFAOYSA-N
XLogP3.69
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.43
LogP ≤ 53.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-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 N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide (CID 20947487) is N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide is Cc1cc(-c2ccc(S(=O)(=O)Nc3ccc(F)cc3C)s2)n[nH]1.
What is the InChIKey of N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide?
The InChIKey is HQQBMEMRGKOJRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14FN3O2S2/c1-9-7-11(16)3-4-12(9)19-23(20,21)15-6-5-14(22-15)13-8-10(2)17-18-13/h3-8,19H,1-2H3,(H,17,18).
What are the key properties of N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide?
N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide has a molecular weight of 351.43 g/mol, XLogP of 3.69, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-fluoro-2-methylphenyl)-5-(5-methyl-1H-pyrazol-3-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 20947487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).