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

C9H12N4O2S2 — CID 60810093

IUPAC5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide
SMILESCC(NS(=O)(=O)c1cn[nH]c1N)c1cccs1
InChIInChI=1S/C9H12N4O2S2/c1-6(7-3-2-4-16-7)13-17(14,15)8-5-11-12-9(8)10/h2-6,13H,1H3,(H3,10,11,12)
InChIKeyVEKJLOCJSHBZSA-UHFFFAOYSA-N
MW272.35 g/mol
LogP1.09
Rot. Bonds4

About 5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide

5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide (PubChem CID 60810093) has the molecular formula C9H12N4O2S2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound Name5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide
PubChem CID60810093
Molecular FormulaC9H12N4O2S2
Molecular Weight272.35 g/mol
Exact Mass272.04
IUPAC Name5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide
SMILESCC(NS(=O)(=O)c1cn[nH]c1N)c1cccs1
InChIInChI=1S/C9H12N4O2S2/c1-6(7-3-2-4-16-7)13-17(14,15)8-5-11-12-9(8)10/h2-6,13H,1H3,(H3,10,11,12)
InChIKeyVEKJLOCJSHBZSA-UHFFFAOYSA-N
XLogP1.09
TPSA100.87 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 51.09
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-amino-N-propan-2-yl-1H-pyrazole-4-sulfonamide
CID 60814185
5-amino-N-(3-methylbutan-2-yl)-1H-pyrazole-4-sulfonamide
CID 60810253
6-amino-N-(1-thiophen-2-ylethyl)pyridine-3-sulfonamide
CID 62148005
5-amino-N-[1-(3-bromophenyl)ethyl]-1H-pyrazole-4-sulfonamide
CID 61125991
4-amino-2-bromo-N-(1-thiophen-2-ylethyl)benzenesulfonamide
CID 43534326
5-amino-4-bromo-2-methyl-N-(1-thiophen-2-ylethyl)benzenesulfonamide
CID 114625113
5-amino-3-fluoro-2-methyl-N-(1-thiophen-2-ylethyl)benzenesulfonamide
CID 79897333
2,5-dibromo-N-(1-thiophen-2-ylethyl)benzenesulfonamide
CID 43001328
5-amino-N-(2,6-dichlorophenyl)-1H-pyrazole-4-sulfonamide
CID 65468674
5-bromo-2-(ethylamino)-N-(1-thiophen-2-ylethyl)pyridine-3-sulfonamide
CID 62148004
5-amino-N-(6-methylheptan-2-yl)-1H-pyrazole-4-sulfonamide
CID 61108156
2-oxo-N-[(1R)-1-thiophen-2-ylethyl]-1,3-dihydrobenzimidazole-5-sulfonamide
CID 8798860

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of 5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide (CID 60810093) is 5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for 5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for 5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide is CC(NS(=O)(=O)c1cn[nH]c1N)c1cccs1.
What is the InChIKey of 5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is VEKJLOCJSHBZSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O2S2/c1-6(7-3-2-4-16-7)13-17(14,15)8-5-11-12-9(8)10/h2-6,13H,1H3,(H3,10,11,12).
What are the key properties of 5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide?
5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 272.35 g/mol, XLogP of 1.09, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-(1-thiophen-2-ylethyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 60810093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).