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

C20H26N2O3S — CID 989293

IUPACN-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide
SMILESCNC(=O)CN(CCc1ccccc1)S(=O)(=O)c1c(C)cc(C)cc1C
InChIInChI=1S/C20H26N2O3S/c1-15-12-16(2)20(17(3)13-15)26(24,25)22(14-19(23)21-4)11-10-18-8-6-5-7-9-18/h5-9,12-13H,10-11,14H2,1-4H3,(H,21,23)
InChIKeySGKAMHPGOXBAIA-UHFFFAOYSA-N
MW374.51 g/mol
LogP2.59
Rot. Bonds7

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

N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide (PubChem CID 989293) has the molecular formula C20H26N2O3S and a molecular weight of 374.51 g/mol. Its IUPAC name is N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide.

Molecular Properties

Compound NameN-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide
PubChem CID989293
Molecular FormulaC20H26N2O3S
Molecular Weight374.51 g/mol
Exact Mass374.17
IUPAC NameN-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide
SMILESCNC(=O)CN(CCc1ccccc1)S(=O)(=O)c1c(C)cc(C)cc1C
InChIInChI=1S/C20H26N2O3S/c1-15-12-16(2)20(17(3)13-15)26(24,25)22(14-19(23)21-4)11-10-18-8-6-5-7-9-18/h5-9,12-13H,10-11,14H2,1-4H3,(H,21,23)
InChIKeySGKAMHPGOXBAIA-UHFFFAOYSA-N
XLogP2.59
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.51
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
The IUPAC name of N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide (CID 989293) is N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide.
What is the SMILES notation for N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
The canonical SMILES for N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide is CNC(=O)CN(CCc1ccccc1)S(=O)(=O)c1c(C)cc(C)cc1C.
What is the InChIKey of N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
The InChIKey is SGKAMHPGOXBAIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S/c1-15-12-16(2)20(17(3)13-15)26(24,25)22(14-19(23)21-4)11-10-18-8-6-5-7-9-18/h5-9,12-13H,10-11,14H2,1-4H3,(H,21,23).
What are the key properties of N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide?
N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide has a molecular weight of 374.51 g/mol, XLogP of 2.59, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-[2-phenylethyl-(2,4,6-trimethylphenyl)sulfonylamino]acetamide is sourced from PubChem (CID 989293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).