N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide

C13H20N2O5S — CID 71924471

IUPACN-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide
SMILESCCS(=O)(=O)N(C)CC(=O)Nc1cc(OC)cc(OC)c1
InChIInChI=1S/C13H20N2O5S/c1-5-21(17,18)15(2)9-13(16)14-10-6-11(19-3)8-12(7-10)20-4/h6-8H,5,9H2,1-4H3,(H,14,16)
InChIKeyVNJVJVOXIIGFNC-UHFFFAOYSA-N
MW316.38 g/mol
LogP0.92
Rot. Bonds7

About N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide

N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide (PubChem CID 71924471) has the molecular formula C13H20N2O5S and a molecular weight of 316.38 g/mol. Its IUPAC name is N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide.

Molecular Properties

Compound NameN-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide
PubChem CID71924471
Molecular FormulaC13H20N2O5S
Molecular Weight316.38 g/mol
Exact Mass316.11
IUPAC NameN-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide
SMILESCCS(=O)(=O)N(C)CC(=O)Nc1cc(OC)cc(OC)c1
InChIInChI=1S/C13H20N2O5S/c1-5-21(17,18)15(2)9-13(16)14-10-6-11(19-3)8-12(7-10)20-4/h6-8H,5,9H2,1-4H3,(H,14,16)
InChIKeyVNJVJVOXIIGFNC-UHFFFAOYSA-N
XLogP0.92
TPSA84.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.38
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(3,4-dimethylphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide
CID 99818118
N-(3-methoxyphenyl)-2-[methyl(methylsulfonyl)amino]acetamide
CID 30464513
N-(3,5-dimethoxyphenyl)-2-[ethyl(2-hydroxyethyl)amino]acetamide
CID 37095514
2-[ethylsulfonyl(methyl)amino]-N-(3-methylphenyl)acetamide
CID 99818114
N-(3,5-dimethoxyphenyl)-2-[(3,5-dimethoxyphenyl)sulfamoyl]acetamide
CID 3759124
2-[3,4-dihydro-2H-1,5-benzodioxepin-7-ylsulfonyl(methyl)amino]-N-(3,5-dimethoxyphenyl)acetamide
CID 24650732
N-(3,5-dimethoxyphenyl)-2-[3,3-dimethylbutan-2-yl(methyl)amino]acetamide
CID 46594714
2-[cycloheptyl(methyl)amino]-N-(3,5-dimethoxyphenyl)acetamide
CID 16577758
N-(3,5-dimethoxyphenyl)-2-sulfanylacetamide
CID 2971820
4-[[2-(3,5-dimethoxyanilino)-2-oxoethyl]-methylamino]butanoic acid
CID 119994299
2-[ethylsulfonyl(methyl)amino]-N-[1-(4-methoxyphenyl)ethyl]acetamide
CID 133255493
2-[(3,5-dichlorophenyl)methyl-methylamino]-N-(3,5-dimethoxyphenyl)acetamide
CID 60514415

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide?
The IUPAC name of N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide (CID 71924471) is N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide.
What is the SMILES notation for N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide?
The canonical SMILES for N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide is CCS(=O)(=O)N(C)CC(=O)Nc1cc(OC)cc(OC)c1.
What is the InChIKey of N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide?
The InChIKey is VNJVJVOXIIGFNC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O5S/c1-5-21(17,18)15(2)9-13(16)14-10-6-11(19-3)8-12(7-10)20-4/h6-8H,5,9H2,1-4H3,(H,14,16).
What are the key properties of N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide?
N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide has a molecular weight of 316.38 g/mol, XLogP of 0.92, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dimethoxyphenyl)-2-[ethylsulfonyl(methyl)amino]acetamide is sourced from PubChem (CID 71924471), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).