2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide

C22H22N2O4S — CID 18075070

IUPAC2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide
SMILESCCOc1ccccc1C(=O)Nc1cccc(S(=O)(=O)N(C)c2ccccc2)c1
InChIInChI=1S/C22H22N2O4S/c1-3-28-21-15-8-7-14-20(21)22(25)23-17-10-9-13-19(16-17)29(26,27)24(2)18-11-5-4-6-12-18/h4-16H,3H2,1-2H3,(H,23,25)
InChIKeyZSQBAOXUGTZVTI-UHFFFAOYSA-N
MW410.50 g/mol
LogP4.16
Rot. Bonds7

About 2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide

2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide (PubChem CID 18075070) has the molecular formula C22H22N2O4S and a molecular weight of 410.50 g/mol. Its IUPAC name is 2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide.

Molecular Properties

Compound Name2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide
PubChem CID18075070
Molecular FormulaC22H22N2O4S
Molecular Weight410.50 g/mol
Exact Mass410.13
IUPAC Name2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide
SMILESCCOc1ccccc1C(=O)Nc1cccc(S(=O)(=O)N(C)c2ccccc2)c1
InChIInChI=1S/C22H22N2O4S/c1-3-28-21-15-8-7-14-20(21)22(25)23-17-10-9-13-19(16-17)29(26,27)24(2)18-11-5-4-6-12-18/h4-16H,3H2,1-2H3,(H,23,25)
InChIKeyZSQBAOXUGTZVTI-UHFFFAOYSA-N
XLogP4.16
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.50
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethoxyphenoxy)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 30601573
N-[3-[methyl(phenyl)sulfamoyl]phenyl]-2-methylsulfanylpyridine-3-carboxamide
CID 4290143
ethyl 2-methyl-6-[[3-[methyl(phenyl)sulfamoyl]phenyl]carbamoyl]pyridine-3-carboxylate
CID 55631134
5-bromo-2-chloro-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide
CID 26896379
2-methoxy-N-[4-[methyl(phenyl)sulfamoyl]phenyl]benzamide
CID 1226771
N-(3-acetylphenyl)-2-ethoxybenzamide
CID 773754
2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
N-[1-[3-(diethylsulfamoyl)anilino]-3-methyl-1-oxobutan-2-yl]-2-ethoxybenzamide
CID 24640018
[2-[3-[methyl(phenyl)sulfamoyl]anilino]-2-oxoethyl] propanoate
CID 7851108
2-(N-methylanilino)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 8689679
2-(4-fluorophenoxy)-N-[3-[methyl(phenyl)sulfamoyl]phenyl]acetamide
CID 42989226
2-chloro-N-[2-[3-[methyl(phenyl)sulfamoyl]anilino]-2-oxoethyl]benzamide
CID 17455691

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide?
The IUPAC name of 2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide (CID 18075070) is 2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide.
What is the SMILES notation for 2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide?
The canonical SMILES for 2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide is CCOc1ccccc1C(=O)Nc1cccc(S(=O)(=O)N(C)c2ccccc2)c1.
What is the InChIKey of 2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide?
The InChIKey is ZSQBAOXUGTZVTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2O4S/c1-3-28-21-15-8-7-14-20(21)22(25)23-17-10-9-13-19(16-17)29(26,27)24(2)18-11-5-4-6-12-18/h4-16H,3H2,1-2H3,(H,23,25).
What are the key properties of 2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide?
2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide has a molecular weight of 410.50 g/mol, XLogP of 4.16, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-[3-[methyl(phenyl)sulfamoyl]phenyl]benzamide is sourced from PubChem (CID 18075070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).