2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide

C16H18N2O3S — CID 8001547

IUPAC2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
SMILESCC(=O)Nc1ccccc1OCC(=O)N(C)Cc1cccs1
InChIInChI=1S/C16H18N2O3S/c1-12(19)17-14-7-3-4-8-15(14)21-11-16(20)18(2)10-13-6-5-9-22-13/h3-9H,10-11H2,1-2H3,(H,17,19)
InChIKeyGBWLPHXSMMHSMH-UHFFFAOYSA-N
MW318.40 g/mol
LogP2.74
Rot. Bonds6

About 2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide

2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 8001547) has the molecular formula C16H18N2O3S and a molecular weight of 318.40 g/mol. Its IUPAC name is 2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
PubChem CID8001547
Molecular FormulaC16H18N2O3S
Molecular Weight318.40 g/mol
Exact Mass318.10
IUPAC Name2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
SMILESCC(=O)Nc1ccccc1OCC(=O)N(C)Cc1cccs1
InChIInChI=1S/C16H18N2O3S/c1-12(19)17-14-7-3-4-8-15(14)21-11-16(20)18(2)10-13-6-5-9-22-13/h3-9H,10-11H2,1-2H3,(H,17,19)
InChIKeyGBWLPHXSMMHSMH-UHFFFAOYSA-N
XLogP2.74
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.40
LogP ≤ 52.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2-methoxyphenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 78762295
2-(2-acetamidophenoxy)-N-methyl-N-[(3-methylthiophen-2-yl)methyl]acetamide
CID 9017979
N-(2-methoxyphenyl)-3-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethoxy]naphthalene-2-carboxamide
CID 46603751
N-methyl-2-phenoxy-N-(thiophen-2-ylmethyl)acetamide
CID 78762396
2-(2-acetamidophenoxy)-N-[(4-chlorophenyl)methyl]-N-methylacetamide
CID 7867334
(2S)-2-[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethoxy]propanoic acid
CID 104876158
2-(4-ethoxyphenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 84601120
2-(2-acetamidophenoxy)-N-(2-cyanoethyl)-N-methylacetamide
CID 43384578
2-(2-acetamidophenoxy)-N,N-diethylacetamide
CID 7688277
2-(4-benzoylphenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 2457089
2-(2-fluorophenoxy)-N-methyl-N-(2-thiophen-2-ylethyl)acetamide
CID 110733468
N-(2-methoxyphenyl)-2-[[2-[methyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]-propylamino]acetamide
CID 51171423

Frequently Asked Questions

What is the IUPAC name of 2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of 2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide (CID 8001547) is 2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for 2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide is CC(=O)Nc1ccccc1OCC(=O)N(C)Cc1cccs1.
What is the InChIKey of 2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is GBWLPHXSMMHSMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3S/c1-12(19)17-14-7-3-4-8-15(14)21-11-16(20)18(2)10-13-6-5-9-22-13/h3-9H,10-11H2,1-2H3,(H,17,19).
What are the key properties of 2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide?
2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 318.40 g/mol, XLogP of 2.74, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-acetamidophenoxy)-N-methyl-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 8001547), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).