2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide

C7H8N4O2S2 — CID 103866466

IUPAC2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2cn[nH]c2)s1
InChIInChI=1S/C7H8N4O2S2/c1-5-8-4-7(14-5)15(12,13)11-6-2-9-10-3-6/h2-4,11H,1H3,(H,9,10)
InChIKeySLSHPLSMCXQYAO-UHFFFAOYSA-N
MW244.30 g/mol
LogP0.98
Rot. Bonds3

About 2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide

2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide (PubChem CID 103866466) has the molecular formula C7H8N4O2S2 and a molecular weight of 244.30 g/mol. Its IUPAC name is 2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound Name2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide
PubChem CID103866466
Molecular FormulaC7H8N4O2S2
Molecular Weight244.30 g/mol
Exact Mass244.01
IUPAC Name2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide
SMILESCc1ncc(S(=O)(=O)Nc2cn[nH]c2)s1
InChIInChI=1S/C7H8N4O2S2/c1-5-8-4-7(14-5)15(12,13)11-6-2-9-10-3-6/h2-4,11H,1H3,(H,9,10)
InChIKeySLSHPLSMCXQYAO-UHFFFAOYSA-N
XLogP0.98
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.30
LogP ≤ 50.98
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide?
The IUPAC name of 2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide (CID 103866466) is 2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for 2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide?
The canonical SMILES for 2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide is Cc1ncc(S(=O)(=O)Nc2cn[nH]c2)s1.
What is the InChIKey of 2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide?
The InChIKey is SLSHPLSMCXQYAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O2S2/c1-5-8-4-7(14-5)15(12,13)11-6-2-9-10-3-6/h2-4,11H,1H3,(H,9,10).
What are the key properties of 2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide?
2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide has a molecular weight of 244.30 g/mol, XLogP of 0.98, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 103866466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).