1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide

C13H18N4O4S2 — CID 22203400

IUPAC1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide
SMILESCCNS(=O)(=O)c1ccc(NS(=O)(=O)c2cnn(CC)c2)cc1
InChIInChI=1S/C13H18N4O4S2/c1-3-15-22(18,19)12-7-5-11(6-8-12)16-23(20,21)13-9-14-17(4-2)10-13/h5-10,15-16H,3-4H2,1-2H3
InChIKeyFMDUNRUHIFOWQX-UHFFFAOYSA-N
MW358.45 g/mol
LogP1.00
Rot. Bonds7

About 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide

1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide (PubChem CID 22203400) has the molecular formula C13H18N4O4S2 and a molecular weight of 358.45 g/mol. Its IUPAC name is 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide.

Molecular Properties

Compound Name1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide
PubChem CID22203400
Molecular FormulaC13H18N4O4S2
Molecular Weight358.45 g/mol
Exact Mass358.08
IUPAC Name1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide
SMILESCCNS(=O)(=O)c1ccc(NS(=O)(=O)c2cnn(CC)c2)cc1
InChIInChI=1S/C13H18N4O4S2/c1-3-15-22(18,19)12-7-5-11(6-8-12)16-23(20,21)13-9-14-17(4-2)10-13/h5-10,15-16H,3-4H2,1-2H3
InChIKeyFMDUNRUHIFOWQX-UHFFFAOYSA-N
XLogP1.00
TPSA110.16 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.45
LogP ≤ 51.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-ethyl-N-[4-[(5-methyl-1,2-oxazol-3-yl)sulfamoyl]phenyl]pyrazole-4-sulfonamide
CID 19684607
N-[4-[(3,4-dimethyl-1,2-oxazol-5-yl)sulfamoyl]phenyl]-1-ethylpyrazole-4-sulfonamide
CID 19683725
N-(1-ethylpyrazol-4-yl)-4-hydrazinylbenzenesulfonamide
CID 43543964
N-[4-(3,5-dimethylpiperidin-1-yl)sulfonylphenyl]-1-ethylpyrazole-4-sulfonamide
CID 17263026
1-ethyl-N-[4-[(6-methoxypyrimidin-4-yl)sulfamoyl]phenyl]pyrazole-4-sulfonamide
CID 22204073
1-ethyl-N-thiophen-3-ylpyrazole-4-sulfonamide
CID 71998246
N-(3-chloro-4-fluorophenyl)-1-ethylpyrazole-4-sulfonamide
CID 6469273
6-chloro-N-(1-ethylpyrazol-4-yl)pyridine-3-sulfonamide
CID 39836918
4-(benzenesulfonamido)-N-ethylbenzenesulfonamide
CID 2230301
1-ethyl-N-[4-(piperidine-1-carbonyl)phenyl]pyrazole-4-sulfonamide
CID 22203721
1-ethyl-N-[4-(2-methylpiperidin-1-yl)sulfonylphenyl]pyrazole-4-sulfonamide
CID 19684559
1-ethyl-N-[4-(3-methylpiperidin-1-yl)sulfonylphenyl]pyrazole-4-sulfonamide
CID 19684462

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide?
The IUPAC name of 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide (CID 22203400) is 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide.
What is the SMILES notation for 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide?
The canonical SMILES for 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide is CCNS(=O)(=O)c1ccc(NS(=O)(=O)c2cnn(CC)c2)cc1.
What is the InChIKey of 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide?
The InChIKey is FMDUNRUHIFOWQX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O4S2/c1-3-15-22(18,19)12-7-5-11(6-8-12)16-23(20,21)13-9-14-17(4-2)10-13/h5-10,15-16H,3-4H2,1-2H3.
What are the key properties of 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide?
1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide has a molecular weight of 358.45 g/mol, XLogP of 1.00, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-N-[4-(ethylsulfamoyl)phenyl]pyrazole-4-sulfonamide is sourced from PubChem (CID 22203400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).