N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide

C19H24N2O4S — CID 30258396

IUPACN-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
SMILESCCOc1cccc(N(CC(=O)Nc2c(C)cccc2C)S(C)(=O)=O)c1
InChIInChI=1S/C19H24N2O4S/c1-5-25-17-11-7-10-16(12-17)21(26(4,23)24)13-18(22)20-19-14(2)8-6-9-15(19)3/h6-12H,5,13H2,1-4H3,(H,20,22)
InChIKeyVLVVBTWUEDIAMY-UHFFFAOYSA-N
MW376.48 g/mol
LogP3.11
Rot. Bonds7

About N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide

N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide (PubChem CID 30258396) has the molecular formula C19H24N2O4S and a molecular weight of 376.48 g/mol. Its IUPAC name is N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
PubChem CID30258396
Molecular FormulaC19H24N2O4S
Molecular Weight376.48 g/mol
Exact Mass376.15
IUPAC NameN-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
SMILESCCOc1cccc(N(CC(=O)Nc2c(C)cccc2C)S(C)(=O)=O)c1
InChIInChI=1S/C19H24N2O4S/c1-5-25-17-11-7-10-16(12-17)21(26(4,23)24)13-18(22)20-19-14(2)8-6-9-15(19)3/h6-12H,5,13H2,1-4H3,(H,20,22)
InChIKeyVLVVBTWUEDIAMY-UHFFFAOYSA-N
XLogP3.11
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.48
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(3-ethoxy-N-methylsulfonylanilino)-N-(3-methylphenyl)acetamide
CID 30257958
2-(3-ethoxy-N-methylsulfonylanilino)-N-(4-ethylphenyl)acetamide
CID 30262151
2-(3-ethoxy-N-methylsulfonylanilino)-N-(2-methyl-5-nitrophenyl)acetamide
CID 30270152
2-(3-ethoxy-N-methylsulfonylanilino)-N-(2-fluorophenyl)acetamide
CID 30264702
N-(2,3-dichlorophenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
CID 30270996
N-(1,5-dimethyl-3-oxo-2-phenylpyrazol-4-yl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
CID 30265732
methyl 3-[[2-(3-ethoxy-N-methylsulfonylanilino)acetyl]amino]benzoate
CID 30272698
2-(3-ethoxy-N-methylsulfonylanilino)-N,N-diethylacetamide
CID 30256331
N-(5-chloro-2-methoxyphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
CID 30264909
2-(3-ethoxy-N-methylsulfonylanilino)-N-methyl-N-phenylacetamide
CID 30272380
N-(2,6-difluorophenyl)-2-(3-methoxy-N-methylsulfonylanilino)acetamide
CID 21372888
N-[2-chloro-5-(trifluoromethyl)phenyl]-2-(3-ethoxy-N-methylsulfonylanilino)acetamide
CID 30268918

Frequently Asked Questions

What is the IUPAC name of N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide?
The IUPAC name of N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide (CID 30258396) is N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide.
What is the SMILES notation for N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide?
The canonical SMILES for N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide is CCOc1cccc(N(CC(=O)Nc2c(C)cccc2C)S(C)(=O)=O)c1.
What is the InChIKey of N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide?
The InChIKey is VLVVBTWUEDIAMY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O4S/c1-5-25-17-11-7-10-16(12-17)21(26(4,23)24)13-18(22)20-19-14(2)8-6-9-15(19)3/h6-12H,5,13H2,1-4H3,(H,20,22).
What are the key properties of N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide?
N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide has a molecular weight of 376.48 g/mol, XLogP of 3.11, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,6-dimethylphenyl)-2-(3-ethoxy-N-methylsulfonylanilino)acetamide is sourced from PubChem (CID 30258396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).