N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide

C15H13Cl2NOS — CID 41126402

IUPACN-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide
SMILESCSc1ccc(CC(=O)Nc2cc(Cl)ccc2Cl)cc1
InChIInChI=1S/C15H13Cl2NOS/c1-20-12-5-2-10(3-6-12)8-15(19)18-14-9-11(16)4-7-13(14)17/h2-7,9H,8H2,1H3,(H,18,19)
InChIKeyFDWFRBFWJIOVSE-UHFFFAOYSA-N
MW326.25 g/mol
LogP4.90
Rot. Bonds4

About N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide

N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide (PubChem CID 41126402) has the molecular formula C15H13Cl2NOS and a molecular weight of 326.25 g/mol. Its IUPAC name is N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide.

Molecular Properties

Compound NameN-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide
PubChem CID41126402
Molecular FormulaC15H13Cl2NOS
Molecular Weight326.25 g/mol
Exact Mass325.01
IUPAC NameN-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide
SMILESCSc1ccc(CC(=O)Nc2cc(Cl)ccc2Cl)cc1
InChIInChI=1S/C15H13Cl2NOS/c1-20-12-5-2-10(3-6-12)8-15(19)18-14-9-11(16)4-7-13(14)17/h2-7,9H,8H2,1H3,(H,18,19)
InChIKeyFDWFRBFWJIOVSE-UHFFFAOYSA-N
XLogP4.90
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.25
LogP ≤ 54.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-dichlorophenyl)-2-(4-sulfanylphenyl)acetamide
CID 107019725
N-(2,5-dichlorophenyl)-2-methylsulfanylacetamide
CID 47097975
N-(2,5-dichlorophenyl)-2-(3,4-dihydroxyphenyl)acetamide
CID 113199169
2-(4-chlorophenyl)-N-[(4-methylsulfanylphenyl)methyl]acetamide
CID 47380839
4-chloro-3-[[2-(4-chlorophenyl)acetyl]amino]benzamide
CID 50875886
N-(5-chloro-2-methylphenyl)-2-(4-fluorophenyl)acetamide
CID 808427
N-(5-amino-2-chlorophenyl)-2-(4-methylphenyl)acetamide
CID 43548738
N-(2,5-dichlorophenyl)-2-(3-hydroxyphenyl)acetamide
CID 61399999
N-(5-chloro-2-hydroxyphenyl)-2-(4-chlorophenyl)acetamide
CID 1262869
2-(1,3-benzodioxol-5-yl)-N-(2,5-dichlorophenyl)acetamide
CID 41107875
2-(4-aminophenyl)-N-(5-chloro-2-fluorophenyl)acetamide
CID 43438160
N-[2-(2,5-dichloroanilino)-2-oxoethyl]-2-phenylacetamide
CID 2449630

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide?
The IUPAC name of N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide (CID 41126402) is N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide.
What is the SMILES notation for N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide?
The canonical SMILES for N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide is CSc1ccc(CC(=O)Nc2cc(Cl)ccc2Cl)cc1.
What is the InChIKey of N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide?
The InChIKey is FDWFRBFWJIOVSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2NOS/c1-20-12-5-2-10(3-6-12)8-15(19)18-14-9-11(16)4-7-13(14)17/h2-7,9H,8H2,1H3,(H,18,19).
What are the key properties of N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide?
N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide has a molecular weight of 326.25 g/mol, XLogP of 4.90, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dichlorophenyl)-2-(4-methylsulfanylphenyl)acetamide is sourced from PubChem (CID 41126402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).