N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide

C19H24N2O3S — CID 112992433

IUPACN-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide
SMILESCc1cc(C)c(S(=O)(=O)NCC(=O)N(C)Cc2ccccc2)c(C)c1
InChIInChI=1S/C19H24N2O3S/c1-14-10-15(2)19(16(3)11-14)25(23,24)20-12-18(22)21(4)13-17-8-6-5-7-9-17/h5-11,20H,12-13H2,1-4H3
InChIKeyGPLMZRWZGNIDIH-UHFFFAOYSA-N
MW360.48 g/mol
LogP2.55
Rot. Bonds6

About N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide

N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide (PubChem CID 112992433) has the molecular formula C19H24N2O3S and a molecular weight of 360.48 g/mol. Its IUPAC name is N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide
PubChem CID112992433
Molecular FormulaC19H24N2O3S
Molecular Weight360.48 g/mol
Exact Mass360.15
IUPAC NameN-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide
SMILESCc1cc(C)c(S(=O)(=O)NCC(=O)N(C)Cc2ccccc2)c(C)c1
InChIInChI=1S/C19H24N2O3S/c1-14-10-15(2)19(16(3)11-14)25(23,24)20-12-18(22)21(4)13-17-8-6-5-7-9-17/h5-11,20H,12-13H2,1-4H3
InChIKeyGPLMZRWZGNIDIH-UHFFFAOYSA-N
XLogP2.55
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.48
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-[(2-methoxy-4,5-dimethylphenyl)sulfonylamino]-N-methylacetamide
CID 112992445
N-benzyl-N-cyclopropyl-3-[(2,4,6-trimethylphenyl)sulfonylamino]propanamide
CID 38253005
N-benzyl-N-methyl-2-[(4-propan-2-ylphenyl)sulfonylamino]acetamide
CID 112992432
N-benzyl-2-[(4-cyanophenyl)sulfonylamino]-N-methylacetamide
CID 112760070
N-benzyl-2-[(3-cyanophenyl)sulfonylamino]-N-methylacetamide
CID 112760071
N-benzyl-2-[(3-chlorophenyl)methylsulfonylamino]-N-methylacetamide
CID 22300743
N-benzyl-N-methyl-2-[(2-methyl-1,3-benzothiazol-6-yl)sulfonylamino]acetamide
CID 6620438
N,N'-dibenzyl-N,N'-dimethylpropanediamide
CID 2392235
N-ethyl-N-(3-methylphenyl)-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide
CID 113002201
N-benzyl-N-methyl-2-(2-methylanilino)acetamide
CID 39367191
N-benzyl-2-[(2-chlorophenyl)methylsulfonylamino]-N-methylacetamide
CID 22300498
N-[2-[benzyl(methyl)amino]-2-oxoethyl]-2-methylbenzamide
CID 51160864

Frequently Asked Questions

What is the IUPAC name of N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide (CID 112992433) is N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide is Cc1cc(C)c(S(=O)(=O)NCC(=O)N(C)Cc2ccccc2)c(C)c1.
What is the InChIKey of N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
The InChIKey is GPLMZRWZGNIDIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O3S/c1-14-10-15(2)19(16(3)11-14)25(23,24)20-12-18(22)21(4)13-17-8-6-5-7-9-17/h5-11,20H,12-13H2,1-4H3.
What are the key properties of N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide has a molecular weight of 360.48 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-N-methyl-2-[(2,4,6-trimethylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 112992433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).