N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide

C11H9N3O2S3 — CID 84587151

IUPACN-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cc(-c2ccsc2)[nH]n1)c1cccs1
InChIInChI=1S/C11H9N3O2S3/c15-19(16,11-2-1-4-18-11)14-10-6-9(12-13-10)8-3-5-17-7-8/h1-7H,(H2,12,13,14)
InChIKeyPIOPYSINQFKVCO-UHFFFAOYSA-N
MW311.41 g/mol
LogP3.00
Rot. Bonds4

About N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide

N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide (PubChem CID 84587151) has the molecular formula C11H9N3O2S3 and a molecular weight of 311.41 g/mol. Its IUPAC name is N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide
PubChem CID84587151
Molecular FormulaC11H9N3O2S3
Molecular Weight311.41 g/mol
Exact Mass310.99
IUPAC NameN-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide
SMILESO=S(=O)(Nc1cc(-c2ccsc2)[nH]n1)c1cccs1
InChIInChI=1S/C11H9N3O2S3/c15-19(16,11-2-1-4-18-11)14-10-6-9(12-13-10)8-3-5-17-7-8/h1-7H,(H2,12,13,14)
InChIKeyPIOPYSINQFKVCO-UHFFFAOYSA-N
XLogP3.00
TPSA74.85 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.41
LogP ≤ 53.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide?
The IUPAC name of N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide (CID 84587151) is N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide.
What is the SMILES notation for N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide?
The canonical SMILES for N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide is O=S(=O)(Nc1cc(-c2ccsc2)[nH]n1)c1cccs1.
What is the InChIKey of N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide?
The InChIKey is PIOPYSINQFKVCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3O2S3/c15-19(16,11-2-1-4-18-11)14-10-6-9(12-13-10)8-3-5-17-7-8/h1-7H,(H2,12,13,14).
What are the key properties of N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide?
N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide has a molecular weight of 311.41 g/mol, XLogP of 3.00, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-thiophen-3-yl-1H-pyrazol-3-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 84587151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).