N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide

C9H11N3O2S2 — CID 47372092

IUPACN-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(NCCc1ccsc1)c1cn[nH]c1
InChIInChI=1S/C9H11N3O2S2/c13-16(14,9-5-10-11-6-9)12-3-1-8-2-4-15-7-8/h2,4-7,12H,1,3H2,(H,10,11)
InChIKeyDQEKMGQIMZYNHC-UHFFFAOYSA-N
MW257.34 g/mol
LogP0.99
Rot. Bonds5

About N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide

N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide (PubChem CID 47372092) has the molecular formula C9H11N3O2S2 and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide
PubChem CID47372092
Molecular FormulaC9H11N3O2S2
Molecular Weight257.34 g/mol
Exact Mass257.03
IUPAC NameN-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide
SMILESO=S(=O)(NCCc1ccsc1)c1cn[nH]c1
InChIInChI=1S/C9H11N3O2S2/c13-16(14,9-5-10-11-6-9)12-3-1-8-2-4-15-7-8/h2,4-7,12H,1,3H2,(H,10,11)
InChIKeyDQEKMGQIMZYNHC-UHFFFAOYSA-N
XLogP0.99
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 50.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(2-thiophen-3-ylethyl)-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

Related Compounds

N-[2-(4-hydroxyphenyl)ethyl]-1H-pyrazole-4-sulfonamide
CID 54903977
4-[2-(1H-pyrazol-4-ylsulfonylamino)ethyl]benzoic acid
CID 60917023
N-[2-(1,3-thiazol-2-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 49460068
5-(2-thiophen-3-ylethylsulfamoyl)-1H-pyrazole-4-carboxylic acid
CID 61473154
N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 47371845
N-[2-(furan-2-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 61026875
N-(3-methylsulfonylpropyl)-1H-pyrazole-4-sulfonamide
CID 47292229
N-[2-(1H-imidazol-5-yl)ethyl]-1H-pyrazole-4-sulfonamide
CID 65231374
5-(aminomethyl)-N-(2-thiophen-3-ylethyl)pyridine-2-sulfonamide
CID 106050116
N-(2-methylsulfanylethyl)-1H-pyrazole-4-sulfonamide
CID 60916750
N-(1H-pyrrol-3-ylmethyl)-1H-pyrazole-4-sulfonamide
CID 106385116
N-propyl-4-(2-thiophen-3-ylethylamino)benzenesulfonamide
CID 61474553

Frequently Asked Questions

What is the IUPAC name of N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide (CID 47372092) is N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide is O=S(=O)(NCCc1ccsc1)c1cn[nH]c1.
What is the InChIKey of N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is DQEKMGQIMZYNHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2S2/c13-16(14,9-5-10-11-6-9)12-3-1-8-2-4-15-7-8/h2,4-7,12H,1,3H2,(H,10,11).
What are the key properties of N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide?
N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 257.34 g/mol, XLogP of 0.99, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-thiophen-3-ylethyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 47372092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).