3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide

C13H18N4O2S — CID 60815181

IUPAC3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide
SMILESCCc1ccc(NS(=O)(=O)c2cn(CC)nc2N)cc1
InChIInChI=1S/C13H18N4O2S/c1-3-10-5-7-11(8-6-10)16-20(18,19)12-9-17(4-2)15-13(12)14/h5-9,16H,3-4H2,1-2H3,(H2,14,15)
InChIKeyJHQQRBNZXSZHPR-UHFFFAOYSA-N
MW294.38 g/mol
LogP1.85
Rot. Bonds5

About 3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide

3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide (PubChem CID 60815181) has the molecular formula C13H18N4O2S and a molecular weight of 294.38 g/mol. Its IUPAC name is 3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide.

Molecular Properties

Compound Name3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide
PubChem CID60815181
Molecular FormulaC13H18N4O2S
Molecular Weight294.38 g/mol
Exact Mass294.12
IUPAC Name3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide
SMILESCCc1ccc(NS(=O)(=O)c2cn(CC)nc2N)cc1
InChIInChI=1S/C13H18N4O2S/c1-3-10-5-7-11(8-6-10)16-20(18,19)12-9-17(4-2)15-13(12)14/h5-9,16H,3-4H2,1-2H3,(H2,14,15)
InChIKeyJHQQRBNZXSZHPR-UHFFFAOYSA-N
XLogP1.85
TPSA90.01 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.38
LogP ≤ 51.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 3-amino-1-ethyl-N-(4-ethylphenyl)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

3-amino-N-(3,5-difluorophenyl)-1-ethylpyrazole-4-sulfonamide
CID 60815193
3-amino-1-ethyl-N-(3-hydroxyphenyl)pyrazole-4-sulfonamide
CID 61167291
3-amino-N-(2,6-dibromophenyl)-1-ethylpyrazole-4-sulfonamide
CID 107596320
3-amino-1-ethyl-N-[(4-methylphenyl)methyl]pyrazole-4-sulfonamide
CID 60813353
3-amino-1-ethyl-N-(2,4,6-trimethylphenyl)pyrazole-4-sulfonamide
CID 60808760
3-amino-N-tert-butyl-1-ethylpyrazole-4-sulfonamide
CID 60814031
3-amino-N-(5,6-dimethyl-1,2,4-triazin-3-yl)-1-ethylpyrazole-4-sulfonamide
CID 114386852
3-amino-N-(1-ethylpyrazol-4-yl)-1-propylpyrazole-4-sulfonamide
CID 60808956
N-(4-ethylphenyl)-1,3-dimethylpyrazole-4-sulfonamide
CID 22773854
3-amino-N-(2,2-difluoroethyl)-1-ethylpyrazole-4-sulfonamide
CID 115405368
3-amino-1-ethyl-N-[2-(4-fluorophenyl)ethyl]pyrazole-4-sulfonamide
CID 60809082
3-amino-N-(5-bromo-2-pyridinyl)-1-ethylpyrazole-4-sulfonamide
CID 54922471

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide?
The IUPAC name of 3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide (CID 60815181) is 3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide.
What is the SMILES notation for 3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide?
The canonical SMILES for 3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide is CCc1ccc(NS(=O)(=O)c2cn(CC)nc2N)cc1.
What is the InChIKey of 3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide?
The InChIKey is JHQQRBNZXSZHPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N4O2S/c1-3-10-5-7-11(8-6-10)16-20(18,19)12-9-17(4-2)15-13(12)14/h5-9,16H,3-4H2,1-2H3,(H2,14,15).
What are the key properties of 3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide?
3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide has a molecular weight of 294.38 g/mol, XLogP of 1.85, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-ethyl-N-(4-ethylphenyl)pyrazole-4-sulfonamide is sourced from PubChem (CID 60815181), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).