2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide

C15H13Cl2NO2S — CID 46669347

IUPAC2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide
SMILESCSc1ccc(NC(=O)COc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C15H13Cl2NO2S/c1-21-11-7-5-10(6-8-11)18-14(19)9-20-15-12(16)3-2-4-13(15)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyCYJHPQVWLSFAQE-UHFFFAOYSA-N
MW342.25 g/mol
LogP4.73
Rot. Bonds5

About 2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide

2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide (PubChem CID 46669347) has the molecular formula C15H13Cl2NO2S and a molecular weight of 342.25 g/mol. Its IUPAC name is 2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide.

Molecular Properties

Compound Name2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide
PubChem CID46669347
Molecular FormulaC15H13Cl2NO2S
Molecular Weight342.25 g/mol
Exact Mass341.00
IUPAC Name2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide
SMILESCSc1ccc(NC(=O)COc2c(Cl)cccc2Cl)cc1
InChIInChI=1S/C15H13Cl2NO2S/c1-21-11-7-5-10(6-8-11)18-14(19)9-20-15-12(16)3-2-4-13(15)17/h2-8H,9H2,1H3,(H,18,19)
InChIKeyCYJHPQVWLSFAQE-UHFFFAOYSA-N
XLogP4.73
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500342.25
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-ethoxyphenoxy)-N-(4-methylsulfanylphenyl)acetamide
CID 24581463
N-(4-aminophenyl)-2-(2-chloro-6-fluorophenoxy)acetamide
CID 83050973
2-(3-methylphenoxy)-N-(4-methylsulfanylphenyl)acetamide
CID 9153755
N-(3-amino-4-chlorophenyl)-2-(2,6-dichlorophenoxy)acetamide
CID 60800025
2-(2-ethylphenoxy)-N-(4-methylsulfanylphenyl)acetamide
CID 46669396
2-(2-anilino-2-oxoethoxy)-3-chlorobenzoic acid
CID 115955933
2-(2,3-dichlorophenoxy)-N-(4-methylphenyl)acetamide
CID 2602907
[2-(4-methylsulfanylanilino)-2-oxoethyl] (2S)-2-[(2-chlorobenzoyl)amino]propanoate
CID 55925854
2-(3,4-dimethylphenoxy)-N-(4-methylsulfanylphenyl)acetamide
CID 9153670
N-(4-bromophenyl)-2-(2-chloro-6-formylphenoxy)acetamide
CID 115955676
N-(4-methylsulfanylphenyl)-2-(3-nitrophenoxy)acetamide
CID 51287734
2-(2-methylquinolin-8-yl)oxy-N-(4-methylsulfanylphenyl)acetamide
CID 24581925

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide?
The IUPAC name of 2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide (CID 46669347) is 2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide.
What is the SMILES notation for 2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide?
The canonical SMILES for 2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide is CSc1ccc(NC(=O)COc2c(Cl)cccc2Cl)cc1.
What is the InChIKey of 2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide?
The InChIKey is CYJHPQVWLSFAQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NO2S/c1-21-11-7-5-10(6-8-11)18-14(19)9-20-15-12(16)3-2-4-13(15)17/h2-8H,9H2,1H3,(H,18,19).
What are the key properties of 2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide?
2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide has a molecular weight of 342.25 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dichlorophenoxy)-N-(4-methylsulfanylphenyl)acetamide is sourced from PubChem (CID 46669347), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).