2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide

C16H18N2O3S — CID 17401958

IUPAC2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide
SMILESCC(=O)Nc1ccccc1OCC(=O)NC(C)c1cccs1
InChIInChI=1S/C16H18N2O3S/c1-11(15-8-5-9-22-15)17-16(20)10-21-14-7-4-3-6-13(14)18-12(2)19/h3-9,11H,10H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyLBRFOTKMXRJKHW-UHFFFAOYSA-N
MW318.40 g/mol
LogP2.96
Rot. Bonds6

About 2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide

2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide (PubChem CID 17401958) has the molecular formula C16H18N2O3S and a molecular weight of 318.40 g/mol. Its IUPAC name is 2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide.

Molecular Properties

Compound Name2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide
PubChem CID17401958
Molecular FormulaC16H18N2O3S
Molecular Weight318.40 g/mol
Exact Mass318.10
IUPAC Name2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide
SMILESCC(=O)Nc1ccccc1OCC(=O)NC(C)c1cccs1
InChIInChI=1S/C16H18N2O3S/c1-11(15-8-5-9-22-15)17-16(20)10-21-14-7-4-3-6-13(14)18-12(2)19/h3-9,11H,10H2,1-2H3,(H,17,20)(H,18,19)
InChIKeyLBRFOTKMXRJKHW-UHFFFAOYSA-N
XLogP2.96
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 52.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-ethoxyphenoxy)-N-[(1R)-1-thiophen-2-ylethyl]acetamide
CID 7918077
2-(2-propan-2-ylphenoxy)-N-(1-thiophen-2-ylethyl)acetamide
CID 45154352
2-(2-bromophenoxy)-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 7847611
2-(2-cyanophenoxy)-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 7742348
2-[2-oxo-2-[[(1R)-1-thiophen-2-ylethyl]amino]ethoxy]-N-phenylbenzamide
CID 40616574
2-(2,4-difluorophenoxy)-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 31849974
2-(2-acetamidophenoxy)-N-[(2S)-5-methylhexan-2-yl]acetamide
CID 9018049
N-[(1S)-1-thiophen-2-ylethyl]-2-(2,4,5-trichlorophenoxy)acetamide
CID 7918061
2-(2,5-dimethylphenoxy)-N-[(1S)-1-thiophen-2-ylethyl]acetamide
CID 8910471
N-[(1R)-1-thiophen-2-ylethyl]-2-[2-(1H-1,2,4-triazol-5-yl)phenoxy]acetamide
CID 97089284
[2-oxo-2-[[(1S)-1-thiophen-2-ylethyl]amino]ethyl] 2-(2-formylphenoxy)acetate
CID 8608475
2-(2-acetamidophenoxy)-N-[(1R)-1-(1-adamantyl)ethyl]acetamide
CID 7867259

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide?
The IUPAC name of 2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide (CID 17401958) is 2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide.
What is the SMILES notation for 2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide?
The canonical SMILES for 2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide is CC(=O)Nc1ccccc1OCC(=O)NC(C)c1cccs1.
What is the InChIKey of 2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide?
The InChIKey is LBRFOTKMXRJKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3S/c1-11(15-8-5-9-22-15)17-16(20)10-21-14-7-4-3-6-13(14)18-12(2)19/h3-9,11H,10H2,1-2H3,(H,17,20)(H,18,19).
What are the key properties of 2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide?
2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide has a molecular weight of 318.40 g/mol, XLogP of 2.96, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetamidophenoxy)-N-(1-thiophen-2-ylethyl)acetamide is sourced from PubChem (CID 17401958), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).