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

C18H22N2O3S — CID 110674498

IUPAC2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide
SMILESCN(C)S(=O)(=O)c1ccc(CC(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C18H22N2O3S/c1-20(2)24(22,23)17-10-8-16(9-11-17)14-18(21)19-13-12-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H,19,21)
InChIKeyNWZSJCARFVOSRB-UHFFFAOYSA-N
MW346.45 g/mol
LogP1.84
Rot. Bonds7

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

2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide (PubChem CID 110674498) has the molecular formula C18H22N2O3S and a molecular weight of 346.45 g/mol. Its IUPAC name is 2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound Name2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide
PubChem CID110674498
Molecular FormulaC18H22N2O3S
Molecular Weight346.45 g/mol
Exact Mass346.14
IUPAC Name2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide
SMILESCN(C)S(=O)(=O)c1ccc(CC(=O)NCCc2ccccc2)cc1
InChIInChI=1S/C18H22N2O3S/c1-20(2)24(22,23)17-10-8-16(9-11-17)14-18(21)19-13-12-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H,19,21)
InChIKeyNWZSJCARFVOSRB-UHFFFAOYSA-N
XLogP1.84
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.45
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[4-(dimethylsulfamoyl)phenyl]ethyl]-5-phenylpentanamide
CID 142727630
3-[2-[4-(dimethylsulfamoyl)phenyl]ethyl]-1-methyl-1-(3-phenylpropyl)urea
CID 142727616
1-[[4-(dimethylsulfamoyl)phenyl]methyl]-2-methyl-3-(2-phenylethyl)guanidine
CID 111134253
N-[2-(4-chlorophenyl)ethyl]-4-(dimethylsulfamoyl)benzamide
CID 2468773
N-[2-(4-hydroxyphenyl)ethyl]-2-phenylacetamide
CID 11857553
4-(dimethylsulfamoyl)-N-ethyl-N-(2-phenylethyl)benzamide
CID 55588043
N-[5-(dimethylsulfamoyl)-2-methylphenyl]-2-phenylacetamide
CID 7689071
1-[2-[4-(dimethylsulfamoyl)phenyl]ethyl]-3-(3-phenylpropyl)-1-propan-2-ylurea
CID 118398387
2-[benzenesulfonyl(benzyl)amino]-N-(2-phenylethyl)acetamide
CID 2681375
[2-oxo-2-(2-phenylethylamino)ethyl] 2-[(4-chlorophenyl)sulfonyl-methylamino]acetate
CID 2386619
N-(2-phenylethyl)-2-[4-(trifluoromethyl)phenyl]acetamide
CID 58853713
4-[4-oxo-4-(2-phenylethylamino)butyl]benzenesulfonic acid
CID 23037515

Frequently Asked Questions

What is the IUPAC name of 2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide?
The IUPAC name of 2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide (CID 110674498) is 2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide.
What is the SMILES notation for 2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide?
The canonical SMILES for 2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide is CN(C)S(=O)(=O)c1ccc(CC(=O)NCCc2ccccc2)cc1.
What is the InChIKey of 2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide?
The InChIKey is NWZSJCARFVOSRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O3S/c1-20(2)24(22,23)17-10-8-16(9-11-17)14-18(21)19-13-12-15-6-4-3-5-7-15/h3-11H,12-14H2,1-2H3,(H,19,21).
What are the key properties of 2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide?
2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide has a molecular weight of 346.45 g/mol, XLogP of 1.84, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(dimethylsulfamoyl)phenyl]-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 110674498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).