N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide

C12H15N3O4S — CID 60917021

IUPACN-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide
SMILESCCOc1ccc(NS(=O)(=O)c2cn[nH]c2)cc1OC
InChIInChI=1S/C12H15N3O4S/c1-3-19-11-5-4-9(6-12(11)18-2)15-20(16,17)10-7-13-14-8-10/h4-8,15H,3H2,1-2H3,(H,13,14)
InChIKeyYUKPSXTXJXWWDB-UHFFFAOYSA-N
MW297.34 g/mol
LogP1.62
Rot. Bonds6

About N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide

N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide (PubChem CID 60917021) has the molecular formula C12H15N3O4S and a molecular weight of 297.34 g/mol. Its IUPAC name is N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide.

Molecular Properties

Compound NameN-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide
PubChem CID60917021
Molecular FormulaC12H15N3O4S
Molecular Weight297.34 g/mol
Exact Mass297.08
IUPAC NameN-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide
SMILESCCOc1ccc(NS(=O)(=O)c2cn[nH]c2)cc1OC
InChIInChI=1S/C12H15N3O4S/c1-3-19-11-5-4-9(6-12(11)18-2)15-20(16,17)10-7-13-14-8-10/h4-8,15H,3H2,1-2H3,(H,13,14)
InChIKeyYUKPSXTXJXWWDB-UHFFFAOYSA-N
XLogP1.62
TPSA93.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.34
LogP ≤ 51.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze N-(4-ethoxy-3-methoxyphenyl)-1H-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

N-(3-bromo-4-methoxyphenyl)-1H-pyrazole-4-sulfonamide
CID 63998008
N-(5-chloro-2-ethoxyphenyl)-1H-pyrazole-4-sulfonamide
CID 47267974
3,4-dimethoxy-N-(1H-pyrazol-4-yl)benzenesulfonamide
CID 43532732
N-(4-ethoxy-3-methoxyphenyl)propane-2-sulfonamide
CID 62997998
3,5-dichloro-N-(3,4-diethoxyphenyl)benzenesulfonamide
CID 8851611
N-(3,4-difluorophenyl)-1H-pyrazole-4-sulfonamide
CID 60912012
2-chloro-N-(4-ethoxy-3-methoxyphenyl)ethanesulfonamide
CID 107650750
N-[3-(2-methoxyethoxy)phenyl]-1H-pyrazole-4-sulfonamide
CID 47267959
N-[5-[(dimethylamino)methyl]-2-methoxyphenyl]-1H-pyrazole-4-sulfonamide
CID 61276279
N-(3-methylsulfonylphenyl)-1H-pyrazole-4-sulfonamide
CID 47267601
2-chloro-N-(3-chloro-4-ethoxyphenyl)pyrimidine-5-sulfonamide
CID 61040955
N-(3-methoxy-4-phenylmethoxyphenyl)benzenesulfonamide
CID 71390494

Frequently Asked Questions

What is the IUPAC name of N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide?
The IUPAC name of N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide (CID 60917021) is N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide.
What is the SMILES notation for N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide?
The canonical SMILES for N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide is CCOc1ccc(NS(=O)(=O)c2cn[nH]c2)cc1OC.
What is the InChIKey of N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide?
The InChIKey is YUKPSXTXJXWWDB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O4S/c1-3-19-11-5-4-9(6-12(11)18-2)15-20(16,17)10-7-13-14-8-10/h4-8,15H,3H2,1-2H3,(H,13,14).
What are the key properties of N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide?
N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide has a molecular weight of 297.34 g/mol, XLogP of 1.62, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethoxy-3-methoxyphenyl)-1H-pyrazole-4-sulfonamide is sourced from PubChem (CID 60917021), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).