2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide

C16H16ClNO2S — CID 2337984

IUPAC2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CSc1ccccc1Cl
InChIInChI=1S/C16H16ClNO2S/c1-2-20-14-9-5-4-8-13(14)18-16(19)11-21-15-10-6-3-7-12(15)17/h3-10H,2,11H2,1H3,(H,18,19)
InChIKeyITISGUUQNZHVSI-UHFFFAOYSA-N
MW321.83 g/mol
LogP4.47
Rot. Bonds6

About 2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide

2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide (PubChem CID 2337984) has the molecular formula C16H16ClNO2S and a molecular weight of 321.83 g/mol. Its IUPAC name is 2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide
PubChem CID2337984
Molecular FormulaC16H16ClNO2S
Molecular Weight321.83 g/mol
Exact Mass321.06
IUPAC Name2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide
SMILESCCOc1ccccc1NC(=O)CSc1ccccc1Cl
InChIInChI=1S/C16H16ClNO2S/c1-2-20-14-9-5-4-8-13(14)18-16(19)11-21-15-10-6-3-7-12(15)17/h3-10H,2,11H2,1H3,(H,18,19)
InChIKeyITISGUUQNZHVSI-UHFFFAOYSA-N
XLogP4.47
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.83
LogP ≤ 54.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-chloro-1H-indol-3-yl)sulfanyl]-N-(2-ethoxyphenyl)acetamide
CID 162647559
N-(2-chlorophenyl)-2-(2-chlorophenyl)sulfanylacetamide
CID 2498952
[2-(2-ethoxyanilino)-2-oxoethyl] 2-[2-(2-ethoxyanilino)-2-oxoethyl]sulfanylbenzoate
CID 3503829
[2-(2-ethoxyanilino)-2-oxoethyl] 2-(2,5-dichlorophenyl)sulfanylacetate
CID 7701704
2-(2-chlorophenyl)sulfanyl-N-(2,3-dichlorophenyl)acetamide
CID 4001438
methyl 2-[[2-(2-chlorophenyl)sulfanylacetyl]amino]benzoate
CID 2554185
2-(2-chlorophenyl)sulfanyl-N-(2-ethoxy-5-morpholin-4-ylsulfonylphenyl)acetamide
CID 27881487
N-(3-chloro-2-methylphenyl)-N'-(2-ethoxyphenyl)propanediamide
CID 108955086
2-[[5-[(2-chlorophenoxy)methyl]-4-ethyl-1,2,4-triazol-3-yl]sulfanyl]-N-(2-ethoxyphenyl)acetamide
CID 19631947
N-(2-ethoxyphenyl)-2-(3-hydroxy-2-methylpropyl)sulfanylacetamide
CID 66102705
N-(2-ethoxyphenyl)-2-quinoxalin-2-ylsulfanylacetamide
CID 34905335
2-(2,3-dichlorophenoxy)-N-(2-ethoxyphenyl)acetamide
CID 7372395

Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide?
The IUPAC name of 2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide (CID 2337984) is 2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide.
What is the SMILES notation for 2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide?
The canonical SMILES for 2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide is CCOc1ccccc1NC(=O)CSc1ccccc1Cl.
What is the InChIKey of 2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide?
The InChIKey is ITISGUUQNZHVSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO2S/c1-2-20-14-9-5-4-8-13(14)18-16(19)11-21-15-10-6-3-7-12(15)17/h3-10H,2,11H2,1H3,(H,18,19).
What are the key properties of 2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide?
2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide has a molecular weight of 321.83 g/mol, XLogP of 4.47, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenyl)sulfanyl-N-(2-ethoxyphenyl)acetamide is sourced from PubChem (CID 2337984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).