3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide

C17H20N2O4S — CID 2591093

IUPAC3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
SMILESCCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C17H20N2O4S/c1-4-23-16-11-6-5-10-15(16)18-17(20)13-8-7-9-14(12-13)24(21,22)19(2)3/h5-12H,4H2,1-3H3,(H,18,20)
InChIKeyGNPSDHVQJUEYRD-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.59
Rot. Bonds6

About 3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide

3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide (PubChem CID 2591093) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide.

Molecular Properties

Compound Name3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
PubChem CID2591093
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
SMILESCCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)N(C)C)c1
InChIInChI=1S/C17H20N2O4S/c1-4-23-16-11-6-5-10-15(16)18-17(20)13-8-7-9-14(12-13)24(21,22)19(2)3/h5-12H,4H2,1-3H3,(H,18,20)
InChIKeyGNPSDHVQJUEYRD-UHFFFAOYSA-N
XLogP2.59
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(diethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591095
3-(dipropylsulfamoyl)-N-(2-ethoxyphenyl)benzamide
CID 2591009
3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)-4-methylbenzamide
CID 110295913
N-(2-ethoxyphenyl)-3-(propylsulfamoyl)benzamide
CID 109061947
3-(dimethylsulfamoyl)-N-(2-methylphenyl)benzamide
CID 2221549
3-(dimethylsulfamoyl)-N-(2-ethoxy-5-piperidin-1-ylsulfonylphenyl)benzamide
CID 4849961
N-(2-ethoxyphenyl)-3-[(2-fluorophenyl)sulfamoyl]benzamide
CID 37311937
4-(aminomethyl)-N-[5-(dimethylsulfamoyl)-2-ethoxyphenyl]benzamide
CID 119331638
N-[2-(2-amino-2-oxoethyl)phenyl]-3-(dimethylsulfamoyl)benzamide
CID 55603942
3-[ethyl(phenyl)sulfamoyl]-N-(2-propoxyphenyl)benzamide
CID 112793585
3-(dimethylsulfamoyl)-N-[5-(dimethylsulfamoyl)-2-methoxyphenyl]benzamide
CID 55341476
3-[ethyl(phenyl)sulfamoyl]-N-(2-methoxyphenyl)benzamide
CID 26914975

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide?
The IUPAC name of 3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide (CID 2591093) is 3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide.
What is the SMILES notation for 3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide?
The canonical SMILES for 3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide is CCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)N(C)C)c1.
What is the InChIKey of 3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide?
The InChIKey is GNPSDHVQJUEYRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-4-23-16-11-6-5-10-15(16)18-17(20)13-8-7-9-14(12-13)24(21,22)19(2)3/h5-12H,4H2,1-3H3,(H,18,20).
What are the key properties of 3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide?
3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.59, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylsulfamoyl)-N-(2-ethoxyphenyl)benzamide is sourced from PubChem (CID 2591093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).