N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide

C18H22N2O4S — CID 87047102

IUPACN-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide
SMILESCCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(C)cc2OCC)c1
InChIInChI=1S/C18H22N2O4S/c1-4-19-25(22,23)15-8-6-7-14(12-15)18(21)20-16-10-9-13(3)11-17(16)24-5-2/h6-12,19H,4-5H2,1-3H3,(H,20,21)
InChIKeyLXUJTEHYQSPYKT-UHFFFAOYSA-N
MW362.45 g/mol
LogP2.94
Rot. Bonds7

About N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide

N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide (PubChem CID 87047102) has the molecular formula C18H22N2O4S and a molecular weight of 362.45 g/mol. Its IUPAC name is N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide.

Molecular Properties

Compound NameN-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide
PubChem CID87047102
Molecular FormulaC18H22N2O4S
Molecular Weight362.45 g/mol
Exact Mass362.13
IUPAC NameN-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide
SMILESCCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(C)cc2OCC)c1
InChIInChI=1S/C18H22N2O4S/c1-4-19-25(22,23)15-8-6-7-14(12-15)18(21)20-16-10-9-13(3)11-17(16)24-5-2/h6-12,19H,4-5H2,1-3H3,(H,20,21)
InChIKeyLXUJTEHYQSPYKT-UHFFFAOYSA-N
XLogP2.94
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.45
LogP ≤ 52.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2,4-dimethylphenyl)-3-(ethylsulfamoyl)benzamide
CID 26538648
3-(ethylsulfamoyl)-N-(2-fluoro-4-methylphenyl)benzamide
CID 26698365
N-(2-ethoxyphenyl)-3-(propylsulfamoyl)benzamide
CID 109061947
3-(ethylsulfamoyl)-N-(4-fluoro-2-methoxyphenyl)benzamide
CID 33069732
N-(2-chlorophenyl)-3-(ethylsulfamoyl)benzamide
CID 26574954
4-ethoxy-N-(2-ethoxy-4-methylphenyl)-3-methoxybenzamide
CID 87027059
N-(5-chloro-2-methoxyphenyl)-3-(ethylsulfamoyl)benzamide
CID 26582371
3-chloro-N-(2-ethoxy-4-methylphenyl)-4-iodobenzamide
CID 103221306
3-[(4-ethoxyphenyl)sulfamoyl]-N-(2-fluoro-4-methylphenyl)benzamide
CID 51547155
3-(butylsulfamoyl)-N-(2,5-dimethylphenyl)benzamide
CID 17226677
N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide
CID 37311937
3-(benzylsulfamoyl)-N-(2,4-dimethylphenyl)benzamide
CID 9342801

Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide?
The IUPAC name of N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide (CID 87047102) is N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide.
What is the SMILES notation for N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide?
The canonical SMILES for N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide is CCNS(=O)(=O)c1cccc(C(=O)Nc2ccc(C)cc2OCC)c1.
What is the InChIKey of N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide?
The InChIKey is LXUJTEHYQSPYKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O4S/c1-4-19-25(22,23)15-8-6-7-14(12-15)18(21)20-16-10-9-13(3)11-17(16)24-5-2/h6-12,19H,4-5H2,1-3H3,(H,20,21).
What are the key properties of N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide?
N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide has a molecular weight of 362.45 g/mol, XLogP of 2.94, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxy-4-methylphenyl)-3-(ethylsulfamoyl)benzamide is sourced from PubChem (CID 87047102), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).