3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide

C17H20N2O4S — CID 25348432

IUPAC3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide
SMILESCCS(=O)(=O)Nc1cccc(C(=O)NCc2ccccc2OC)c1
InChIInChI=1S/C17H20N2O4S/c1-3-24(21,22)19-15-9-6-8-13(11-15)17(20)18-12-14-7-4-5-10-16(14)23-2/h4-11,19H,3,12H2,1-2H3,(H,18,20)
InChIKeyQYBPARRMAGWBEM-UHFFFAOYSA-N
MW348.42 g/mol
LogP2.39
Rot. Bonds7

About 3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide

3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide (PubChem CID 25348432) has the molecular formula C17H20N2O4S and a molecular weight of 348.42 g/mol. Its IUPAC name is 3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide.

Molecular Properties

Compound Name3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide
PubChem CID25348432
Molecular FormulaC17H20N2O4S
Molecular Weight348.42 g/mol
Exact Mass348.11
IUPAC Name3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide
SMILESCCS(=O)(=O)Nc1cccc(C(=O)NCc2ccccc2OC)c1
InChIInChI=1S/C17H20N2O4S/c1-3-24(21,22)19-15-9-6-8-13(11-15)17(20)18-12-14-7-4-5-10-16(14)23-2/h4-11,19H,3,12H2,1-2H3,(H,18,20)
InChIKeyQYBPARRMAGWBEM-UHFFFAOYSA-N
XLogP2.39
TPSA84.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.42
LogP ≤ 52.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-(benzenesulfonamido)-N-[(2-methoxyphenyl)methyl]benzamide
CID 9164278
N-[(2,3-dimethoxyphenyl)methyl]-3-(methanesulfonamido)benzamide
CID 55583363
3-(chloromethyl)-N-[(2-methoxyphenyl)methyl]benzamide
CID 43333393
N-[(2-methoxyphenyl)methyl]-3-(trifluoromethyl)benzamide
CID 2713294
4-chloro-3-[(3,4-dimethylphenyl)sulfamoyl]-N-[(2-methoxyphenyl)methyl]benzamide
CID 126416161
3-N-(3,4-dimethylphenyl)-1-N-[(2-methoxyphenyl)methyl]benzene-1,3-dicarboxamide
CID 109054817
N-(2-ethylphenyl)-3-(ethylsulfonylamino)benzamide
CID 36859745
N-[(2-methoxyphenyl)methyl]-3-[methyl(propan-2-yl)sulfamoyl]benzamide
CID 26734370
3-[ethyl(phenyl)sulfamoyl]-N-[(2-methoxyphenyl)methyl]benzamide
CID 26734441
4-methoxy-N-[(2-methoxyphenyl)methyl]-3-sulfamoylbenzamide
CID 36717267
4-methoxy-N-[(2-methoxyphenyl)methyl]-3-methylbenzamide
CID 17018061
4-[(3,4-dimethylphenyl)sulfamoyl]-N-[(2-methoxyphenyl)methyl]benzamide
CID 26775951

Frequently Asked Questions

What is the IUPAC name of 3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide?
The IUPAC name of 3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide (CID 25348432) is 3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide.
What is the SMILES notation for 3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide?
The canonical SMILES for 3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide is CCS(=O)(=O)Nc1cccc(C(=O)NCc2ccccc2OC)c1.
What is the InChIKey of 3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide?
The InChIKey is QYBPARRMAGWBEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O4S/c1-3-24(21,22)19-15-9-6-8-13(11-15)17(20)18-12-14-7-4-5-10-16(14)23-2/h4-11,19H,3,12H2,1-2H3,(H,18,20).
What are the key properties of 3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide?
3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide has a molecular weight of 348.42 g/mol, XLogP of 2.39, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(ethylsulfonylamino)-N-[(2-methoxyphenyl)methyl]benzamide is sourced from PubChem (CID 25348432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).