N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide

C14H22N2O3S — CID 30256486

IUPACN,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
SMILESCc1cc(C)c(N(CC(=O)N(C)C)S(C)(=O)=O)c(C)c1
InChIInChI=1S/C14H22N2O3S/c1-10-7-11(2)14(12(3)8-10)16(20(6,18)19)9-13(17)15(4)5/h7-8H,9H2,1-6H3
InChIKeyZCWCQUNYQMTQLM-UHFFFAOYSA-N
MW298.41 g/mol
LogP1.47
Rot. Bonds4

About N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide

N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide (PubChem CID 30256486) has the molecular formula C14H22N2O3S and a molecular weight of 298.41 g/mol. Its IUPAC name is N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
PubChem CID30256486
Molecular FormulaC14H22N2O3S
Molecular Weight298.41 g/mol
Exact Mass298.14
IUPAC NameN,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
SMILESCc1cc(C)c(N(CC(=O)N(C)C)S(C)(=O)=O)c(C)c1
InChIInChI=1S/C14H22N2O3S/c1-10-7-11(2)14(12(3)8-10)16(20(6,18)19)9-13(17)15(4)5/h7-8H,9H2,1-6H3
InChIKeyZCWCQUNYQMTQLM-UHFFFAOYSA-N
XLogP1.47
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 51.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-(2-pyridin-4-ylethyl)-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 113154369
N-ethyl-N-(3-methylphenyl)-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 113154382
N-[(2R)-3-methylbutan-2-yl]-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 125072566
N-[(4-methylphenyl)methyl]-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 30263870
N-pentyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 30269796
N-(3,5-dichlorophenyl)-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 30261658
ethyl 2-(2,6-dimethyl-N-methylsulfonylanilino)acetate
CID 2217801
2-(2-chloro-4,6-dimethyl-N-methylsulfonylanilino)-N-ethyl-N-phenylacetamide
CID 113155053
N-(5-chloro-2-methylphenyl)-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide
CID 30265111
dimethyl 5-[[2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetyl]amino]benzene-1,3-dicarboxylate
CID 30276302
2-(3-chloro-N-methylsulfonylanilino)-N,N-dimethylacetamide
CID 846764
2-(N-ethylsulfonyl-2,4,6-trimethylanilino)acetyl chloride
CID 50891943

Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide?
The IUPAC name of N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide (CID 30256486) is N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide.
What is the SMILES notation for N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide?
The canonical SMILES for N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide is Cc1cc(C)c(N(CC(=O)N(C)C)S(C)(=O)=O)c(C)c1.
What is the InChIKey of N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide?
The InChIKey is ZCWCQUNYQMTQLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O3S/c1-10-7-11(2)14(12(3)8-10)16(20(6,18)19)9-13(17)15(4)5/h7-8H,9H2,1-6H3.
What are the key properties of N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide?
N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide has a molecular weight of 298.41 g/mol, XLogP of 1.47, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2,4,6-trimethyl-N-methylsulfonylanilino)acetamide is sourced from PubChem (CID 30256486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).