N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide

C20H26N2O3S — CID 113002201

IUPACN-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide
SMILESCCN(C(=O)CNS(=O)(=O)c1c(C)cc(C)cc1C)c1cccc(C)c1
InChIInChI=1S/C20H26N2O3S/c1-6-22(18-9-7-8-14(2)12-18)19(23)13-21-26(24,25)20-16(4)10-15(3)11-17(20)5/h7-12,21H,6,13H2,1-5H3
InChIKeyGCRSMRYOHHNOJD-UHFFFAOYSA-N
MW374.51 g/mol
LogP3.25
Rot. Bonds6

About N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide

N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide (PubChem CID 113002201) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide
PubChem CID113002201
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC NameN-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide
SMILESCCN(C(=O)CNS(=O)(=O)c1c(C)cc(C)cc1C)c1cccc(C)c1
InChIInChI=1S/C20H26N2O3S/c1-6-22(18-9-7-8-14(2)12-18)19(23)13-21-26(24,25)20-16(4)10-15(3)11-17(20)5/h7-12,21H,6,13H2,1-5H3
InChIKeyGCRSMRYOHHNOJD-UHFFFAOYSA-N
XLogP3.25
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 53.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-ethyl-2-(ethylsulfonylamino)-N-(3-methylphenyl)acetamide
CID 113002186
2-(butylsulfonylamino)-N-ethyl-N-(3-methylphenyl)acetamide
CID 113002188
N-ethyl-N-(3-methylphenyl)-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 113154382
N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide
CID 772299
3-(benzenesulfonamido)-N-ethyl-N-(3-methylphenyl)propanamide
CID 17226000
2-[2-(dimethylamino)ethylamino]-N-ethyl-N-(3-methylphenyl)acetamide
CID 108994566
4-tert-butyl-N-[2-(N-ethyl-3-methylanilino)-2-oxoethyl]benzamide
CID 113002146
3-(N-ethyl-3-methylanilino)-3-oxopropane-1-sulfonyl chloride
CID 98489365
3-amino-N-ethyl-N-(3-methylphenyl)propanamide
CID 22692119
N-(2,4-dimethylphenyl)-N'-ethyl-N'-(3-methylphenyl)propanediamide
CID 108953533
N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide
CID 112992433
3-(2,4-dimethylanilino)-N-ethyl-N-(3-methylphenyl)propanamide
CID 109035243

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide (CID 113002201) is N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide is CCN(C(=O)CNS(=O)(=O)c1c(C)cc(C)cc1C)c1cccc(C)c1.
What is the InChIKey of N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
The InChIKey is GCRSMRYOHHNOJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-6-22(18-9-7-8-14(2)12-18)19(23)13-21-26(24,25)20-16(4)10-15(3)11-17(20)5/h7-12,21H,6,13H2,1-5H3.
What are the key properties of N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide has a molecular weight of 374.51 g/mol, XLogP of 3.25, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 113002201), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).