2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide

C24H27N3O3S — CID 18170938

IUPAC2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
SMILESCN(C)S(=O)(=O)c1ccc(NC(=O)CN(Cc2ccccc2)Cc2ccccc2)cc1
InChIInChI=1S/C24H27N3O3S/c1-26(2)31(29,30)23-15-13-22(14-16-23)25-24(28)19-27(17-20-9-5-3-6-10-20)18-21-11-7-4-8-12-21/h3-16H,17-19H2,1-2H3,(H,25,28)
InChIKeyJPOQVVAYRZPEGQ-UHFFFAOYSA-N
MW437.57 g/mol
LogP3.58
Rot. Bonds9

About 2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide

2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide (PubChem CID 18170938) has the molecular formula C24H27N3O3S and a molecular weight of 437.57 g/mol. Its IUPAC name is 2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
PubChem CID18170938
Molecular FormulaC24H27N3O3S
Molecular Weight437.57 g/mol
Exact Mass437.18
IUPAC Name2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
SMILESCN(C)S(=O)(=O)c1ccc(NC(=O)CN(Cc2ccccc2)Cc2ccccc2)cc1
InChIInChI=1S/C24H27N3O3S/c1-26(2)31(29,30)23-15-13-22(14-16-23)25-24(28)19-27(17-20-9-5-3-6-10-20)18-21-11-7-4-8-12-21/h3-16H,17-19H2,1-2H3,(H,25,28)
InChIKeyJPOQVVAYRZPEGQ-UHFFFAOYSA-N
XLogP3.58
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.57
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[benzyl(ethyl)amino]-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 8533359
2-(diethylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 17432578
2-(dibenzylamino)-N-(4-methylphenyl)acetamide
CID 18870817
2-[benzenesulfonyl(benzyl)amino]-N-(4-methylphenyl)acetamide
CID 2854852
2-(benzenesulfonyl)-N-[4-[benzyl(methyl)sulfamoyl]phenyl]acetamide
CID 3936175
N-[4-(dimethylsulfamoyl)phenyl]-2-[furan-2-ylmethyl(methyl)amino]acetamide
CID 9331913
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-[cyclohexyl(methyl)amino]acetamide
CID 55409399
N-[4-[benzyl(methyl)sulfamoyl]phenyl]-2-[methyl-[(2-methylphenyl)methyl]amino]acetamide
CID 26583009
2-[benzyl(ethyl)amino]-N-[4-(dimethylamino)phenyl]acetamide
CID 108998932
N-[4-(dimethylsulfamoyl)phenyl]-2-phenylsulfanylacetamide
CID 2082856
N-[2-[4-(dimethylsulfamoyl)anilino]-2-oxoethyl]benzamide
CID 4788124
2-[benzyl-(4-methylphenyl)sulfonylamino]-N-(4-iodophenyl)acetamide
CID 1209132

Frequently Asked Questions

What is the IUPAC name of 2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide?
The IUPAC name of 2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide (CID 18170938) is 2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for 2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide?
The canonical SMILES for 2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide is CN(C)S(=O)(=O)c1ccc(NC(=O)CN(Cc2ccccc2)Cc2ccccc2)cc1.
What is the InChIKey of 2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide?
The InChIKey is JPOQVVAYRZPEGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27N3O3S/c1-26(2)31(29,30)23-15-13-22(14-16-23)25-24(28)19-27(17-20-9-5-3-6-10-20)18-21-11-7-4-8-12-21/h3-16H,17-19H2,1-2H3,(H,25,28).
What are the key properties of 2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide?
2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide has a molecular weight of 437.57 g/mol, XLogP of 3.58, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dibenzylamino)-N-[4-(dimethylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 18170938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).