N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide

C16H20N4O4S — CID 122355933

IUPACN-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide
SMILESCCOc1nc(C)c(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c(C)n1
InChIInChI=1S/C16H20N4O4S/c1-5-24-16-17-10(2)15(11(3)18-16)20-25(22,23)14-8-6-13(7-9-14)19-12(4)21/h6-9,20H,5H2,1-4H3,(H,19,21)
InChIKeyZQDVKUHRSURMMI-UHFFFAOYSA-N
MW364.43 g/mol
LogP2.25
Rot. Bonds6

About N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide

N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide (PubChem CID 122355933) has the molecular formula C16H20N4O4S and a molecular weight of 364.43 g/mol. Its IUPAC name is N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide.

Molecular Properties

Compound NameN-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide
PubChem CID122355933
Molecular FormulaC16H20N4O4S
Molecular Weight364.43 g/mol
Exact Mass364.12
IUPAC NameN-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide
SMILESCCOc1nc(C)c(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c(C)n1
InChIInChI=1S/C16H20N4O4S/c1-5-24-16-17-10(2)15(11(3)18-16)20-25(22,23)14-8-6-13(7-9-14)19-12(4)21/h6-9,20H,5H2,1-4H3,(H,19,21)
InChIKeyZQDVKUHRSURMMI-UHFFFAOYSA-N
XLogP2.25
TPSA110.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.43
LogP ≤ 52.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-4-ethylbenzenesulfonamide
CID 121137078
3-chloro-N-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-4-methoxybenzenesulfonamide
CID 122356165
N-(2-ethoxy-4,6-dimethylpyrimidin-5-yl)-4-methyl-3,5-dinitrobenzenesulfonamide
CID 122356193
N-[4-[(2,6-diethylphenyl)sulfamoyl]phenyl]acetamide
CID 2725688
N-[4-[(4-methoxypyrimidin-2-yl)sulfamoyl]phenyl]acetamide
CID 25048024
N-[4-[(4-ethylphenyl)sulfamoyl]phenyl]acetamide
CID 798958
N-[4-[(2,3,4,5,6-pentafluorophenyl)sulfamoyl]phenyl]acetamide
CID 5193248
ethyl N-[4-[(4-ethoxyphenyl)sulfamoyl]phenyl]carbamate
CID 17147479
4-methoxy-N-(2-methoxy-4,6-dimethylpyrimidin-5-yl)benzenesulfonamide
CID 122302660
N-[4-[[4-(propylsulfamoyl)phenyl]sulfamoyl]phenyl]acetamide
CID 2134216
N-[4-[(4-acetamidophenyl)sulfonylsulfamoyl]phenyl]acetamide
CID 71349024
N-[4-[(3-propoxyquinoxalin-2-yl)sulfamoyl]phenyl]acetamide
CID 7693406

Frequently Asked Questions

What is the IUPAC name of N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide?
The IUPAC name of N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide (CID 122355933) is N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide.
What is the SMILES notation for N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide?
The canonical SMILES for N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide is CCOc1nc(C)c(NS(=O)(=O)c2ccc(NC(C)=O)cc2)c(C)n1.
What is the InChIKey of N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide?
The InChIKey is ZQDVKUHRSURMMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N4O4S/c1-5-24-16-17-10(2)15(11(3)18-16)20-25(22,23)14-8-6-13(7-9-14)19-12(4)21/h6-9,20H,5H2,1-4H3,(H,19,21).
What are the key properties of N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide?
N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide has a molecular weight of 364.43 g/mol, XLogP of 2.25, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[(2-ethoxy-4,6-dimethylpyrimidin-5-yl)sulfamoyl]phenyl]acetamide is sourced from PubChem (CID 122355933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).