2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide

C18H20N2O5S — CID 2710573

IUPAC2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
SMILESCC(=O)c1cccc(OCC(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)c1
InChIInChI=1S/C18H20N2O5S/c1-13(21)14-5-4-6-16(11-14)25-12-18(22)19-15-7-9-17(10-8-15)26(23,24)20(2)3/h4-11H,12H2,1-3H3,(H,19,22)
InChIKeyPJLNEXYUGFVAER-UHFFFAOYSA-N
MW376.43 g/mol
LogP2.16
Rot. Bonds7

About 2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide

2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide (PubChem CID 2710573) has the molecular formula C18H20N2O5S and a molecular weight of 376.43 g/mol. Its IUPAC name is 2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
PubChem CID2710573
Molecular FormulaC18H20N2O5S
Molecular Weight376.43 g/mol
Exact Mass376.11
IUPAC Name2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
SMILESCC(=O)c1cccc(OCC(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)c1
InChIInChI=1S/C18H20N2O5S/c1-13(21)14-5-4-6-16(11-14)25-12-18(22)19-15-7-9-17(10-8-15)26(23,24)20(2)3/h4-11H,12H2,1-3H3,(H,19,22)
InChIKeyPJLNEXYUGFVAER-UHFFFAOYSA-N
XLogP2.16
TPSA92.78 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.43
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(3-chlorophenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 2632951
N-(4-acetamidophenyl)-2-(3-acetylphenoxy)acetamide
CID 2627260
2-(3-acetylphenoxy)-N-(4-methylphenyl)acetamide
CID 2616941
N-[3-(dimethylsulfamoyl)phenyl]-2-(3-iodophenoxy)acetamide
CID 35986913
2-[4-[[2-(3-acetylphenoxy)acetyl]amino]phenyl]-N-methylacetamide
CID 35365218
2-(4-chlorophenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide
CID 2710578
2-(3-acetylphenoxy)-N-[4-[[3-(trifluoromethyl)phenyl]sulfamoyl]phenyl]acetamide
CID 4801122
2-(3-acetylphenoxy)-N-[3-(methoxymethyl)phenyl]acetamide
CID 33099560
2-(3,4-dimethylphenoxy)-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 4798692
N-[4-(dimethylsulfamoyl)phenyl]-2-methoxyacetamide
CID 9494871
N-[4-(dimethylsulfamoyl)phenyl]-2-(4-nitrophenoxy)acetamide
CID 1416689
2-(3,5-dimethoxyphenoxy)-N-[3-(dimethylsulfamoyl)phenyl]acetamide
CID 7713817

Frequently Asked Questions

What is the IUPAC name of 2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide?
The IUPAC name of 2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide (CID 2710573) is 2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide.
What is the SMILES notation for 2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide?
The canonical SMILES for 2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide is CC(=O)c1cccc(OCC(=O)Nc2ccc(S(=O)(=O)N(C)C)cc2)c1.
What is the InChIKey of 2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide?
The InChIKey is PJLNEXYUGFVAER-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O5S/c1-13(21)14-5-4-6-16(11-14)25-12-18(22)19-15-7-9-17(10-8-15)26(23,24)20(2)3/h4-11H,12H2,1-3H3,(H,19,22).
What are the key properties of 2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide?
2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide has a molecular weight of 376.43 g/mol, XLogP of 2.16, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-acetylphenoxy)-N-[4-(dimethylsulfamoyl)phenyl]acetamide is sourced from PubChem (CID 2710573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).