5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide

C9H11N3O2S2 — CID 18125780

IUPAC5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccn(C)n2)s1
InChIInChI=1S/C9H11N3O2S2/c1-7-3-4-9(15-7)16(13,14)11-8-5-6-12(2)10-8/h3-6H,1-2H3,(H,10,11)
InChIKeyZGCDFQFXUMGXFX-UHFFFAOYSA-N
MW257.34 g/mol
LogP1.59
Rot. Bonds3

About 5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide

5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide (PubChem CID 18125780) has the molecular formula C9H11N3O2S2 and a molecular weight of 257.34 g/mol. Its IUPAC name is 5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide.

Molecular Properties

Compound Name5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide
PubChem CID18125780
Molecular FormulaC9H11N3O2S2
Molecular Weight257.34 g/mol
Exact Mass257.03
IUPAC Name5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide
SMILESCc1ccc(S(=O)(=O)Nc2ccn(C)n2)s1
InChIInChI=1S/C9H11N3O2S2/c1-7-3-4-9(15-7)16(13,14)11-8-5-6-12(2)10-8/h3-6H,1-2H3,(H,10,11)
InChIKeyZGCDFQFXUMGXFX-UHFFFAOYSA-N
XLogP1.59
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide?
The IUPAC name of 5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide (CID 18125780) is 5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide.
What is the SMILES notation for 5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide?
The canonical SMILES for 5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide is Cc1ccc(S(=O)(=O)Nc2ccn(C)n2)s1.
What is the InChIKey of 5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide?
The InChIKey is ZGCDFQFXUMGXFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N3O2S2/c1-7-3-4-9(15-7)16(13,14)11-8-5-6-12(2)10-8/h3-6H,1-2H3,(H,10,11).
What are the key properties of 5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide?
5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide has a molecular weight of 257.34 g/mol, XLogP of 1.59, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(1-methylpyrazol-3-yl)thiophene-2-sulfonamide is sourced from PubChem (CID 18125780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).