2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide

C16H19NO2S — CID 32959130

IUPAC2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide
SMILESCCc1ccc(OCC(=O)NCc2sccc2C)cc1
InChIInChI=1S/C16H19NO2S/c1-3-13-4-6-14(7-5-13)19-11-16(18)17-10-15-12(2)8-9-20-15/h4-9H,3,10-11H2,1-2H3,(H,17,18)
InChIKeyRLVYEZNDZCFRDZ-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.31
Rot. Bonds6

About 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide

2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide (PubChem CID 32959130) has the molecular formula C16H19NO2S and a molecular weight of 289.40 g/mol. Its IUPAC name is 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide
PubChem CID32959130
Molecular FormulaC16H19NO2S
Molecular Weight289.40 g/mol
Exact Mass289.11
IUPAC Name2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide
SMILESCCc1ccc(OCC(=O)NCc2sccc2C)cc1
InChIInChI=1S/C16H19NO2S/c1-3-13-4-6-14(7-5-13)19-11-16(18)17-10-15-12(2)8-9-20-15/h4-9H,3,10-11H2,1-2H3,(H,17,18)
InChIKeyRLVYEZNDZCFRDZ-UHFFFAOYSA-N
XLogP3.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]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-methoxyphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 32959031
2-(4-aminophenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 78985015
2-(5,6-dimethylpyridazin-3-yl)oxy-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 56782751
2-(4-aminophenoxy)-N-[(4-ethylphenyl)methyl]acetamide
CID 106899089
2-[3-(1-hydroxyethyl)phenoxy]-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 71968834
2-[[[2-(4-ethylphenoxy)acetyl]amino]methyl]-1,3-thiazole-4-carboxylic acid
CID 119244722
2-(4-ethylphenoxy)-N-(pyridin-4-ylmethyl)acetamide
CID 957282
1-[(4-ethylphenyl)methyl]-1-methyl-3-[(3-methylthiophen-2-yl)methyl]urea
CID 33421833
2-[4-[(3,5-dimethyl-1,2-oxazol-4-yl)methoxy]phenyl]-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 30861007
2-(4-ethylphenoxy)-N-(2-methylpropyl)acetamide
CID 1120997
2-[4-[2-(4-fluorophenoxy)acetyl]piperazin-1-yl]-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 78897047
1-(4-ethoxyphenyl)-N-[(3-methylthiophen-2-yl)methyl]methanamine
CID 113221923

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide?
The IUPAC name of 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide (CID 32959130) is 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide.
What is the SMILES notation for 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide?
The canonical SMILES for 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide is CCc1ccc(OCC(=O)NCc2sccc2C)cc1.
What is the InChIKey of 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide?
The InChIKey is RLVYEZNDZCFRDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2S/c1-3-13-4-6-14(7-5-13)19-11-16(18)17-10-15-12(2)8-9-20-15/h4-9H,3,10-11H2,1-2H3,(H,17,18).
What are the key properties of 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide?
2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide has a molecular weight of 289.40 g/mol, XLogP of 3.31, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenoxy)-N-[(3-methylthiophen-2-yl)methyl]acetamide is sourced from PubChem (CID 32959130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).