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

C9H12N4O2S2 — CID 103414971

IUPACN-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide
SMILESCCc1cn[nH]c1NS(=O)(=O)c1cnc(C)s1
InChIInChI=1S/C9H12N4O2S2/c1-3-7-4-11-12-9(7)13-17(14,15)8-5-10-6(2)16-8/h4-5H,3H2,1-2H3,(H2,11,12,13)
InChIKeyNJAWFIQGRFZADC-UHFFFAOYSA-N
MW272.36 g/mol
LogP1.54
Rot. Bonds4

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

N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide (PubChem CID 103414971) has the molecular formula C9H12N4O2S2 and a molecular weight of 272.36 g/mol. Its IUPAC name is N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide.

Molecular Properties

Compound NameN-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide
PubChem CID103414971
Molecular FormulaC9H12N4O2S2
Molecular Weight272.36 g/mol
Exact Mass272.04
IUPAC NameN-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide
SMILESCCc1cn[nH]c1NS(=O)(=O)c1cnc(C)s1
InChIInChI=1S/C9H12N4O2S2/c1-3-7-4-11-12-9(7)13-17(14,15)8-5-10-6(2)16-8/h4-5H,3H2,1-2H3,(H2,11,12,13)
InChIKeyNJAWFIQGRFZADC-UHFFFAOYSA-N
XLogP1.54
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.36
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methyl-N-(1H-pyrazol-4-yl)-1,3-thiazole-5-sulfonamide
CID 103866466
N-(1H-indazol-6-yl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 97242161
N-(4-ethyl-1H-pyrazol-5-yl)propane-1-sulfonamide
CID 104620984
4-amino-N-(4-ethyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 104617220
N-(4-ethyl-1H-pyrazol-5-yl)-3-methylbenzenesulfonamide
CID 113433884
2-amino-N-(4-ethyl-1H-pyrazol-5-yl)-4,5-dimethylbenzenesulfonamide
CID 104617260
4-ethoxy-N-(4-ethyl-1H-pyrazol-5-yl)benzenesulfonamide
CID 104620964
5-[(4-ethyl-1H-pyrazol-5-yl)sulfamoyl]-1,3-thiazole-4-carboxylic acid
CID 104617669
N-(2-hydroxybutyl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 103414895
N-(1-bromobutan-2-yl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 103416070
2,5-dibromo-N-(4-ethyl-1H-pyrazol-5-yl)-4-methylbenzenesulfonamide
CID 104620958
N-(1-cyanobutan-2-yl)-2-methyl-1,3-thiazole-5-sulfonamide
CID 104694078

Frequently Asked Questions

What is the IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide?
The IUPAC name of N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide (CID 103414971) is N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide.
What is the SMILES notation for N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide?
The canonical SMILES for N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide is CCc1cn[nH]c1NS(=O)(=O)c1cnc(C)s1.
What is the InChIKey of N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide?
The InChIKey is NJAWFIQGRFZADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4O2S2/c1-3-7-4-11-12-9(7)13-17(14,15)8-5-10-6(2)16-8/h4-5H,3H2,1-2H3,(H2,11,12,13).
What are the key properties of N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide?
N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide has a molecular weight of 272.36 g/mol, XLogP of 1.54, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethyl-1H-pyrazol-5-yl)-2-methyl-1,3-thiazole-5-sulfonamide is sourced from PubChem (CID 103414971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).