2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide

C24H26N2O4S — CID 29466113

IUPAC2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide
SMILESCN(C)S(=O)(=O)c1ccccc1CNC(=O)COc1ccccc1Cc1ccccc1
InChIInChI=1S/C24H26N2O4S/c1-26(2)31(28,29)23-15-9-7-13-21(23)17-25-24(27)18-30-22-14-8-6-12-20(22)16-19-10-4-3-5-11-19/h3-15H,16-18H2,1-2H3,(H,25,27)
InChIKeyGZFBHUHHKQWEAS-UHFFFAOYSA-N
MW438.55 g/mol
LogP3.22
Rot. Bonds9

About 2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide

2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide (PubChem CID 29466113) has the molecular formula C24H26N2O4S and a molecular weight of 438.55 g/mol. Its IUPAC name is 2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide
PubChem CID29466113
Molecular FormulaC24H26N2O4S
Molecular Weight438.55 g/mol
Exact Mass438.16
IUPAC Name2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide
SMILESCN(C)S(=O)(=O)c1ccccc1CNC(=O)COc1ccccc1Cc1ccccc1
InChIInChI=1S/C24H26N2O4S/c1-26(2)31(28,29)23-15-9-7-13-21(23)17-25-24(27)18-30-22-14-8-6-12-20(22)16-19-10-4-3-5-11-19/h3-15H,16-18H2,1-2H3,(H,25,27)
InChIKeyGZFBHUHHKQWEAS-UHFFFAOYSA-N
XLogP3.22
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500438.55
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-benzylphenoxy)-N-[[2-(ethoxymethyl)phenyl]methyl]acetamide
CID 55599195
1-benzyl-3-[[2-(dimethylsulfamoyl)phenyl]methyl]urea
CID 24664693
2-(2-benzylphenoxy)-N-methylacetamide
CID 7661700
2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide
CID 29468555
2-(2-benzylphenoxy)-N-methylsulfonylacetamide
CID 134106534
2-(benzylcarbamoylamino)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide
CID 24614024
2-(2-benzylphenoxy)-N-(2-methylpropyl)acetamide
CID 112779271
N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methylphenyl)acetamide
CID 41267217
N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methoxyphenyl)acetamide
CID 26060329
2-(2,6-dimethylanilino)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide
CID 32908705
2-(2-benzylphenoxy)-N-(3-ethoxypropyl)acetamide
CID 78760776
2-[[2-(2-benzylphenoxy)acetyl]amino]-N-(2,6-dimethylphenyl)acetamide
CID 24680148

Frequently Asked Questions

What is the IUPAC name of 2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide?
The IUPAC name of 2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide (CID 29466113) is 2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide is CN(C)S(=O)(=O)c1ccccc1CNC(=O)COc1ccccc1Cc1ccccc1.
What is the InChIKey of 2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide?
The InChIKey is GZFBHUHHKQWEAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O4S/c1-26(2)31(28,29)23-15-9-7-13-21(23)17-25-24(27)18-30-22-14-8-6-12-20(22)16-19-10-4-3-5-11-19/h3-15H,16-18H2,1-2H3,(H,25,27).
What are the key properties of 2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide?
2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide has a molecular weight of 438.55 g/mol, XLogP of 3.22, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-benzylphenoxy)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide is sourced from PubChem (CID 29466113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).