N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

C15H19N3O4S2 — CID 26060361

IUPACN-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCc1csc(=O)n1CC(=O)NCc1ccccc1S(=O)(=O)N(C)C
InChIInChI=1S/C15H19N3O4S2/c1-11-10-23-15(20)18(11)9-14(19)16-8-12-6-4-5-7-13(12)24(21,22)17(2)3/h4-7,10H,8-9H2,1-3H3,(H,16,19)
InChIKeyQYYQYAVEXPNWAT-UHFFFAOYSA-N
MW369.47 g/mol
LogP0.78
Rot. Bonds6

About N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide

N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (PubChem CID 26060361) has the molecular formula C15H19N3O4S2 and a molecular weight of 369.47 g/mol. Its IUPAC name is N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.

Molecular Properties

Compound NameN-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
PubChem CID26060361
Molecular FormulaC15H19N3O4S2
Molecular Weight369.47 g/mol
Exact Mass369.08
IUPAC NameN-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide
SMILESCc1csc(=O)n1CC(=O)NCc1ccccc1S(=O)(=O)N(C)C
InChIInChI=1S/C15H19N3O4S2/c1-11-10-23-15(20)18(11)9-14(19)16-8-12-6-4-5-7-13(12)24(21,22)17(2)3/h4-7,10H,8-9H2,1-3H3,(H,16,19)
InChIKeyQYYQYAVEXPNWAT-UHFFFAOYSA-N
XLogP0.78
TPSA88.48 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.47
LogP ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The IUPAC name of N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide (CID 26060361) is N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide.
What is the SMILES notation for N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The canonical SMILES for N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is Cc1csc(=O)n1CC(=O)NCc1ccccc1S(=O)(=O)N(C)C.
What is the InChIKey of N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
The InChIKey is QYYQYAVEXPNWAT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O4S2/c1-11-10-23-15(20)18(11)9-14(19)16-8-12-6-4-5-7-13(12)24(21,22)17(2)3/h4-7,10H,8-9H2,1-3H3,(H,16,19).
What are the key properties of N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide?
N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide has a molecular weight of 369.47 g/mol, XLogP of 0.78, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2-(4-methyl-2-oxo-1,3-thiazol-3-yl)acetamide is sourced from PubChem (CID 26060361), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).