N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide

C16H19NO3S — CID 7742393

IUPACN-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1ccc(C)cc1C
InChIInChI=1S/C16H19NO3S/c1-4-20-15-8-6-5-7-14(15)17-21(18,19)16-10-9-12(2)11-13(16)3/h5-11,17H,4H2,1-3H3
InChIKeySIZYAYFDCWDHHO-UHFFFAOYSA-N
MW305.40 g/mol
LogP3.50
Rot. Bonds5

About N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide

N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide (PubChem CID 7742393) has the molecular formula C16H19NO3S and a molecular weight of 305.40 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide
PubChem CID7742393
Molecular FormulaC16H19NO3S
Molecular Weight305.40 g/mol
Exact Mass305.11
IUPAC NameN-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide
SMILESCCOc1ccccc1NS(=O)(=O)c1ccc(C)cc1C
InChIInChI=1S/C16H19NO3S/c1-4-20-15-8-6-5-7-14(15)17-21(18,19)16-10-9-12(2)11-13(16)3/h5-11,17H,4H2,1-3H3
InChIKeySIZYAYFDCWDHHO-UHFFFAOYSA-N
XLogP3.50
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.40
LogP ≤ 53.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide 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-(2-ethoxyphenyl)-2-methoxy-4-methylbenzenesulfonamide
CID 50876640
4-chloro-N-(2-ethoxyphenyl)-2,5-dimethylbenzenesulfonamide
CID 22774232
3-[(2,4-dimethylphenyl)sulfamoyl]-N-(2-ethoxyphenyl)-4-methylbenzamide
CID 1260706
4-chloro-3-[(2,4-dimethylphenyl)sulfamoyl]-N-(2-ethoxyphenyl)benzamide
CID 126387173
5-chloro-N-(2-ethoxyphenyl)-2-methoxy-4-methylbenzenesulfonamide
CID 9267445
2-[(2,4-dimethylphenyl)sulfonylamino]-N-(2-ethoxyphenyl)-4-methyl-1,3-thiazole-5-carboxamide
CID 16945138
N-(2-ethoxyphenyl)-2-methoxy-4-methyl-5-propan-2-ylbenzenesulfonamide
CID 39847542
N-(2-ethoxyphenyl)-2-methyl-4-(2-oxopyrrolidin-1-yl)benzenesulfonamide
CID 86848405
3-amino-N-(2-ethoxyphenyl)-2-methylbenzenesulfonamide
CID 30058477
4-fluoro-2-methyl-N-[2-(2,2,2-trifluoroethoxy)phenyl]benzenesulfonamide
CID 46535021
2-bromo-N-(2-ethoxyphenyl)-4,5-dimethoxybenzenesulfonamide
CID 27658176
N-(2-ethoxyphenyl)-2-methyl-4-(1,1,3-trioxo-1,2-thiazolidin-2-yl)benzenesulfonamide
CID 22694559

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide?
The IUPAC name of N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide (CID 7742393) is N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide?
The canonical SMILES for N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide is CCOc1ccccc1NS(=O)(=O)c1ccc(C)cc1C.
What is the InChIKey of N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide?
The InChIKey is SIZYAYFDCWDHHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO3S/c1-4-20-15-8-6-5-7-14(15)17-21(18,19)16-10-9-12(2)11-13(16)3/h5-11,17H,4H2,1-3H3.
What are the key properties of N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide?
N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide has a molecular weight of 305.40 g/mol, XLogP of 3.50, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-2,4-dimethylbenzenesulfonamide is sourced from PubChem (CID 7742393), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).