2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide

C19H24N2O3S — CID 113154121

IUPAC2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)CN(c2ccccc2CC)S(C)(=O)=O)cc1
InChIInChI=1S/C19H24N2O3S/c1-4-15-10-12-17(13-11-15)20-19(22)14-21(25(3,23)24)18-9-7-6-8-16(18)5-2/h6-13H,4-5,14H2,1-3H3,(H,20,22)
InChIKeyDZOLDGMKTWYYHR-UHFFFAOYSA-N
MW360.48 g/mol
LogP3.22
Rot. Bonds7

About 2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide

2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide (PubChem CID 113154121) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is 2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide
PubChem CID113154121
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC Name2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide
SMILESCCc1ccc(NC(=O)CN(c2ccccc2CC)S(C)(=O)=O)cc1
InChIInChI=1S/C19H24N2O3S/c1-4-15-10-12-17(13-11-15)20-19(22)14-21(25(3,23)24)18-9-7-6-8-16(18)5-2/h6-13H,4-5,14H2,1-3H3,(H,20,22)
InChIKeyDZOLDGMKTWYYHR-UHFFFAOYSA-N
XLogP3.22
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 53.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-phenoxyanilino)acetamide
CID 30262141
N-(4-ethylphenyl)-2-(N-methylsulfonyl-2-propan-2-yloxyanilino)acetamide
CID 113155378
N-(3-acetamidophenyl)-2-(2-ethyl-N-methylsulfonylanilino)acetamide
CID 113154134
2-(4-ethyl-N-methylsulfonylanilino)-N-phenylacetamide
CID 951908
N-(2-ethyl-6-methylphenyl)-2-(2-ethyl-N-methylsulfonylanilino)acetamide
CID 113154123
N-[4-(dimethylamino)phenyl]-2-(4-ethyl-N-methylsulfonylanilino)acetamide
CID 113154194
N-(2-tert-butylphenyl)-2-(2-ethyl-N-methylsulfonylanilino)acetamide
CID 113154127
N-(4-butylphenyl)-2-(2-fluoro-N-methylsulfonylanilino)acetamide
CID 2209357
2-(2-ethyl-N-methylsulfonylanilino)-N-[4-[(4-methylpyrimidin-2-yl)sulfamoyl]phenyl]acetamide
CID 30392480
N-(4-acetylphenyl)-3-(2-ethyl-N-methylsulfonylanilino)propanamide
CID 113142761
N-butyl-2-(2-ethyl-N-methylsulfonylanilino)acetamide
CID 27255894
2-(N-methylsulfonyl-2-propan-2-ylanilino)-N-phenylacetamide
CID 30257747

Frequently Asked Questions

What is the IUPAC name of 2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide?
The IUPAC name of 2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide (CID 113154121) is 2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide.
What is the SMILES notation for 2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide?
The canonical SMILES for 2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide is CCc1ccc(NC(=O)CN(c2ccccc2CC)S(C)(=O)=O)cc1.
What is the InChIKey of 2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide?
The InChIKey is DZOLDGMKTWYYHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-4-15-10-12-17(13-11-15)20-19(22)14-21(25(3,23)24)18-9-7-6-8-16(18)5-2/h6-13H,4-5,14H2,1-3H3,(H,20,22).
What are the key properties of 2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide?
2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide has a molecular weight of 360.48 g/mol, XLogP of 3.22, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-ethyl-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide is sourced from PubChem (CID 113154121), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).