2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide

C18H20N2O2S — CID 7574875

IUPAC2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide
SMILESO=C(CSCC(=O)Nc1ccccc1)NCCc1ccccc1
InChIInChI=1S/C18H20N2O2S/c21-17(19-12-11-15-7-3-1-4-8-15)13-23-14-18(22)20-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,19,21)(H,20,22)
InChIKeyUSNSIFLPWJYLBL-UHFFFAOYSA-N
MW328.44 g/mol
LogP2.72
Rot. Bonds8

About 2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide

2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide (PubChem CID 7574875) has the molecular formula C18H20N2O2S and a molecular weight of 328.44 g/mol. Its IUPAC name is 2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide.

Molecular Properties

Compound Name2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide
PubChem CID7574875
Molecular FormulaC18H20N2O2S
Molecular Weight328.44 g/mol
Exact Mass328.12
IUPAC Name2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide
SMILESO=C(CSCC(=O)Nc1ccccc1)NCCc1ccccc1
InChIInChI=1S/C18H20N2O2S/c21-17(19-12-11-15-7-3-1-4-8-15)13-23-14-18(22)20-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,19,21)(H,20,22)
InChIKeyUSNSIFLPWJYLBL-UHFFFAOYSA-N
XLogP2.72
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-phenylethyl)-2-(2-phenylethylsulfanyl)acetamide
CID 118398418
3-[[2-(2-anilino-2-oxoethyl)sulfanylacetyl]amino]propanoic acid
CID 82032731
sodium 2-[2-oxo-2-(2-phenylethylamino)ethyl]sulfanylacetate
CID 155944067
2-benzylsulfanyl-N-phenylacetamide
CID 584914
N-phenyl-2-(2-pyridin-4-ylethylsulfanyl)acetamide
CID 100724139
2-[2-(4-fluoroanilino)-2-oxoethyl]sulfanyl-N-(2-pyridin-3-ylethyl)acetamide
CID 55555065
N-[2-(3-fluorophenyl)ethyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetamide
CID 31738193
N-[2-(3-chlorophenyl)ethyl]-2-[2-(4-methylanilino)-2-oxoethyl]sulfanylacetamide
CID 39731212
2-(2-anilino-2-oxoethyl)sulfanylacetate
CID 5216476
2-[(4-methylphenyl)methylsulfanyl]-N-(2-phenylethyl)acetamide
CID 5152285
2-[2-(4-methylanilino)-2-oxoethyl]sulfanyl-N-[2-(1-phenylpyrazol-4-yl)ethyl]acetamide
CID 55505000
N'-(4-chlorophenyl)-N-(2-phenylethyl)propanediamide
CID 108947987

Frequently Asked Questions

What is the IUPAC name of 2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide?
The IUPAC name of 2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide (CID 7574875) is 2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide.
What is the SMILES notation for 2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide?
The canonical SMILES for 2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide is O=C(CSCC(=O)Nc1ccccc1)NCCc1ccccc1.
What is the InChIKey of 2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide?
The InChIKey is USNSIFLPWJYLBL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2S/c21-17(19-12-11-15-7-3-1-4-8-15)13-23-14-18(22)20-16-9-5-2-6-10-16/h1-10H,11-14H2,(H,19,21)(H,20,22).
What are the key properties of 2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide?
2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide has a molecular weight of 328.44 g/mol, XLogP of 2.72, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-anilino-2-oxoethyl)sulfanyl-N-(2-phenylethyl)acetamide is sourced from PubChem (CID 7574875), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).