2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide

C17H27N3O4S — CID 47020357

IUPAC2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide
SMILESCC1CN(CC(=O)NCc2ccccc2S(=O)(=O)N(C)C)CC(C)O1
InChIInChI=1S/C17H27N3O4S/c1-13-10-20(11-14(2)24-13)12-17(21)18-9-15-7-5-6-8-16(15)25(22,23)19(3)4/h5-8,13-14H,9-12H2,1-4H3,(H,18,21)
InChIKeyMIADVLPAXFWSMX-UHFFFAOYSA-N
MW369.49 g/mol
LogP0.66
Rot. Bonds6

About 2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide

2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide (PubChem CID 47020357) has the molecular formula C17H27N3O4S and a molecular weight of 369.49 g/mol. Its IUPAC name is 2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide
PubChem CID47020357
Molecular FormulaC17H27N3O4S
Molecular Weight369.49 g/mol
Exact Mass369.17
IUPAC Name2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide
SMILESCC1CN(CC(=O)NCc2ccccc2S(=O)(=O)N(C)C)CC(C)O1
InChIInChI=1S/C17H27N3O4S/c1-13-10-20(11-14(2)24-13)12-17(21)18-9-15-7-5-6-8-16(15)25(22,23)19(3)4/h5-8,13-14H,9-12H2,1-4H3,(H,18,21)
InChIKeyMIADVLPAXFWSMX-UHFFFAOYSA-N
XLogP0.66
TPSA78.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.49
LogP ≤ 50.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide?
The IUPAC name of 2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide (CID 47020357) is 2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide.
What is the SMILES notation for 2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide?
The canonical SMILES for 2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide is CC1CN(CC(=O)NCc2ccccc2S(=O)(=O)N(C)C)CC(C)O1.
What is the InChIKey of 2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide?
The InChIKey is MIADVLPAXFWSMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O4S/c1-13-10-20(11-14(2)24-13)12-17(21)18-9-15-7-5-6-8-16(15)25(22,23)19(3)4/h5-8,13-14H,9-12H2,1-4H3,(H,18,21).
What are the key properties of 2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide?
2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide has a molecular weight of 369.49 g/mol, XLogP of 0.66, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylmorpholin-4-yl)-N-[[2-(dimethylsulfamoyl)phenyl]methyl]acetamide is sourced from PubChem (CID 47020357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).