N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide

C13H17N3O3S — CID 22209123

IUPACN-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2cnn(C)c2C)cc1
InChIInChI=1S/C13H17N3O3S/c1-4-19-11-5-7-12(8-6-11)20(17,18)15-13-9-14-16(3)10(13)2/h5-9,15H,4H2,1-3H3
InChIKeySZVRWVKVBGHWKC-UHFFFAOYSA-N
MW295.36 g/mol
LogP1.93
Rot. Bonds5

About N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide

N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide (PubChem CID 22209123) has the molecular formula C13H17N3O3S and a molecular weight of 295.36 g/mol. Its IUPAC name is N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide.

Molecular Properties

Compound NameN-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide
PubChem CID22209123
Molecular FormulaC13H17N3O3S
Molecular Weight295.36 g/mol
Exact Mass295.10
IUPAC NameN-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide
SMILESCCOc1ccc(S(=O)(=O)Nc2cnn(C)c2C)cc1
InChIInChI=1S/C13H17N3O3S/c1-4-19-11-5-7-12(8-6-11)20(17,18)15-13-9-14-16(3)10(13)2/h5-9,15H,4H2,1-3H3
InChIKeySZVRWVKVBGHWKC-UHFFFAOYSA-N
XLogP1.93
TPSA73.22 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.36
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide 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-(5-chloro-1-methylpyrazol-4-yl)-4-ethoxybenzenesulfonamide
CID 126823958
N-(4-ethoxyphenyl)-1,5-dimethylpyrazole-4-sulfonamide
CID 22774219
N-[4-[(1,5-dimethylpyrazol-4-yl)sulfamoyl]phenyl]acetamide
CID 22209149
4-ethoxy-N-(1-ethyl-3-methylpyrazol-4-yl)benzenesulfonamide
CID 22209222
N-(4,6-dimethylpyrimidin-2-yl)-4-ethoxybenzenesulfonamide
CID 22202469
4-ethoxy-N-(2-ethoxyphenyl)benzenesulfonamide
CID 7559506
4-ethoxy-N-(4-methylphenyl)benzenesulfonamide
CID 925010
4-ethoxy-N-(2-fluoro-4-methylphenyl)benzenesulfonamide
CID 8523206
N-(2-chloro-4-methylphenyl)-4-ethoxybenzenesulfonamide
CID 7514268
N-(1,5-dimethylpyrazol-4-yl)-2,4-dimethylbenzenesulfonamide
CID 22209133
4-ethoxy-N-(2-methylquinolin-8-yl)benzenesulfonamide
CID 110734192
4-ethoxy-N-(7-ethyl-2-methyl-5,6,8,9-tetrahydropyrido[2,3-d]azepin-3-yl)benzenesulfonamide
CID 130246316

Frequently Asked Questions

What is the IUPAC name of N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide?
The IUPAC name of N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide (CID 22209123) is N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide.
What is the SMILES notation for N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide?
The canonical SMILES for N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide is CCOc1ccc(S(=O)(=O)Nc2cnn(C)c2C)cc1.
What is the InChIKey of N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide?
The InChIKey is SZVRWVKVBGHWKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17N3O3S/c1-4-19-11-5-7-12(8-6-11)20(17,18)15-13-9-14-16(3)10(13)2/h5-9,15H,4H2,1-3H3.
What are the key properties of N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide?
N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide has a molecular weight of 295.36 g/mol, XLogP of 1.93, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,5-dimethylpyrazol-4-yl)-4-ethoxybenzenesulfonamide is sourced from PubChem (CID 22209123), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).