2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide

C15H17NO2S2 — CID 78791455

IUPAC2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide
SMILESCOc1ccc(SCC(=O)NC(C)c2cccs2)cc1
InChIInChI=1S/C15H17NO2S2/c1-11(14-4-3-9-19-14)16-15(17)10-20-13-7-5-12(18-2)6-8-13/h3-9,11H,10H2,1-2H3,(H,16,17)
InChIKeyGXYVPAPPTAFCGZ-UHFFFAOYSA-N
MW307.44 g/mol
LogP3.73
Rot. Bonds6

About 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide

2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide (PubChem CID 78791455) has the molecular formula C15H17NO2S2 and a molecular weight of 307.44 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide
PubChem CID78791455
Molecular FormulaC15H17NO2S2
Molecular Weight307.44 g/mol
Exact Mass307.07
IUPAC Name2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide
SMILESCOc1ccc(SCC(=O)NC(C)c2cccs2)cc1
InChIInChI=1S/C15H17NO2S2/c1-11(14-4-3-9-19-14)16-15(17)10-20-13-7-5-12(18-2)6-8-13/h3-9,11H,10H2,1-2H3,(H,16,17)
InChIKeyGXYVPAPPTAFCGZ-UHFFFAOYSA-N
XLogP3.73
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.44
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2-(4-chlorophenyl)sulfanyl-N-[(1R)-1-thiophen-2-ylethyl]acetamide
CID 7501191
2-[1-(4-methoxyphenyl)tetrazol-5-yl]sulfanyl-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 7462729
2-[(6-methoxy-1H-benzimidazol-2-yl)sulfanyl]-N-[(1R)-1-thiophen-2-ylethyl]acetamide
CID 41023729
N-[(1S)-1-(4-methoxyphenyl)ethyl]-2-(4-methylphenyl)sulfanylacetamide
CID 28574214
2-(4,6-dimethylpyrimidin-2-yl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide
CID 42990207
2-(4-chlorophenyl)sulfanyl-N-[(1S)-1-(4-methoxyphenyl)ethyl]acetamide
CID 92680171
2-[[2-(4-methoxyphenyl)sulfanylacetyl]amino]propanoic acid
CID 43241779
N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-2-(4-methoxyphenyl)sulfanylacetamide
CID 9478267
N-[(1R)-1-thiophen-2-ylethyl]-2-(4,5,6-trimethylpyrimidin-2-yl)sulfanylacetamide
CID 40682887
N-[(1R)-1-(3,4-dimethylphenyl)ethyl]-2-(4-methoxyphenyl)sulfanylacetamide
CID 8907978
N-[(2S)-1-hydroxy-3-methylbutan-2-yl]-2-(4-methoxyphenyl)sulfanylacetamide
CID 79246128
2-[2-(4-methoxyphenyl)-1,3-thiazol-4-yl]-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 40820049

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide?
The IUPAC name of 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide (CID 78791455) is 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide.
What is the SMILES notation for 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide?
The canonical SMILES for 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide is COc1ccc(SCC(=O)NC(C)c2cccs2)cc1.
What is the InChIKey of 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide?
The InChIKey is GXYVPAPPTAFCGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO2S2/c1-11(14-4-3-9-19-14)16-15(17)10-20-13-7-5-12(18-2)6-8-13/h3-9,11H,10H2,1-2H3,(H,16,17).
What are the key properties of 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide?
2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide has a molecular weight of 307.44 g/mol, XLogP of 3.73, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)sulfanyl-N-(1-thiophen-2-ylethyl)acetamide is sourced from PubChem (CID 78791455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).