N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide

C20H26N2O4S — CID 109063672

IUPACN-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide
SMILESCOCCNC(=O)c1cccc(S(=O)(=O)Nc2c(C)cccc2C(C)C)c1
InChIInChI=1S/C20H26N2O4S/c1-14(2)18-10-5-7-15(3)19(18)22-27(24,25)17-9-6-8-16(13-17)20(23)21-11-12-26-4/h5-10,13-14,22H,11-12H2,1-4H3,(H,21,23)
InChIKeySSKNWHBQYGBRFU-UHFFFAOYSA-N
MW390.51 g/mol
LogP3.30
Rot. Bonds8

About N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide

N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide (PubChem CID 109063672) has the molecular formula C20H26N2O4S and a molecular weight of 390.51 g/mol. Its IUPAC name is N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide.

Molecular Properties

Compound NameN-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide
PubChem CID109063672
Molecular FormulaC20H26N2O4S
Molecular Weight390.51 g/mol
Exact Mass390.16
IUPAC NameN-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide
SMILESCOCCNC(=O)c1cccc(S(=O)(=O)Nc2c(C)cccc2C(C)C)c1
InChIInChI=1S/C20H26N2O4S/c1-14(2)18-10-5-7-15(3)19(18)22-27(24,25)17-9-6-8-16(13-17)20(23)21-11-12-26-4/h5-10,13-14,22H,11-12H2,1-4H3,(H,21,23)
InChIKeySSKNWHBQYGBRFU-UHFFFAOYSA-N
XLogP3.30
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.51
LogP ≤ 53.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide 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-N-(2-methoxyethyl)-3-N-(2-methyl-6-propan-2-ylphenyl)benzene-1,3-dicarboxamide
CID 109052582
methyl 3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzoate
CID 99582827
N-(2-methoxyethyl)-3-(propan-2-ylsulfamoyl)benzamide
CID 26500829
N-(2-methoxyethyl)-3-(phenylsulfamoyl)benzamide
CID 19257386
4-[(2,6-dimethylphenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
CID 109059730
N-(2-methoxyethyl)-3-(2-methoxyethylsulfamoyl)benzamide
CID 55565687
3-[(2-ethylphenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
CID 109063665
3-[(2-bromo-5-methylphenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
CID 26500853
3-[(2,6-dimethylphenyl)sulfamoyl]-N-pentylbenzamide
CID 109065412
3-(methylsulfamoyl)-N-[2-(2-propan-2-ylphenoxy)ethyl]benzamide
CID 99116231
N-(2-methylpropyl)-3-[(2-propan-2-ylphenyl)sulfamoyl]benzamide
CID 109062830
3-[(2,5-dimethoxyphenyl)sulfamoyl]-N-(2-methoxyethyl)benzamide
CID 109063687

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide?
The IUPAC name of N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide (CID 109063672) is N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide.
What is the SMILES notation for N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide?
The canonical SMILES for N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide is COCCNC(=O)c1cccc(S(=O)(=O)Nc2c(C)cccc2C(C)C)c1.
What is the InChIKey of N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide?
The InChIKey is SSKNWHBQYGBRFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O4S/c1-14(2)18-10-5-7-15(3)19(18)22-27(24,25)17-9-6-8-16(13-17)20(23)21-11-12-26-4/h5-10,13-14,22H,11-12H2,1-4H3,(H,21,23).
What are the key properties of N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide?
N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide has a molecular weight of 390.51 g/mol, XLogP of 3.30, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-3-[(2-methyl-6-propan-2-ylphenyl)sulfamoyl]benzamide is sourced from PubChem (CID 109063672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).