2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide

C13H13NO2S — CID 78806113

IUPAC2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide
SMILESO=C(Cc1ccc(O)cc1)NCc1cccs1
InChIInChI=1S/C13H13NO2S/c15-11-5-3-10(4-6-11)8-13(16)14-9-12-2-1-7-17-12/h1-7,15H,8-9H2,(H,14,16)
InChIKeyFUTXPTAAOYLPKZ-UHFFFAOYSA-N
MW247.32 g/mol
LogP2.31
Rot. Bonds4

About 2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide

2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide (PubChem CID 78806113) has the molecular formula C13H13NO2S and a molecular weight of 247.32 g/mol. Its IUPAC name is 2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide
PubChem CID78806113
Molecular FormulaC13H13NO2S
Molecular Weight247.32 g/mol
Exact Mass247.07
IUPAC Name2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide
SMILESO=C(Cc1ccc(O)cc1)NCc1cccs1
InChIInChI=1S/C13H13NO2S/c15-11-5-3-10(4-6-11)8-13(16)14-9-12-2-1-7-17-12/h1-7,15H,8-9H2,(H,14,16)
InChIKeyFUTXPTAAOYLPKZ-UHFFFAOYSA-N
XLogP2.31
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.32
LogP ≤ 52.31
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-thiophen-2-yl-N-(thiophen-2-ylmethyl)acetamide
CID 1245174
2-(4-acetamidophenyl)-N-(thiophen-2-ylmethyl)acetamide
CID 9363258
2-(4-ethoxyphenyl)-N-(thiophen-2-ylmethyl)acetamide
CID 17172905
2-(3,4-dimethylphenyl)-N-(thiophen-2-ylmethyl)acetamide
CID 2675121
N-(thiophen-2-ylmethyl)-2-[4-(trifluoromethoxy)phenyl]acetamide
CID 46482581
2-fluoro-N-(thiophen-2-ylmethyl)acetamide
CID 150063829
N,N'-bis(thiophen-2-ylmethyl)oxamide
CID 6421749
2-thiophen-2-yl-N-[2-[(2-thiophen-2-ylacetyl)amino]ethyl]acetamide
CID 25146649
2-(4-hydroxyphenyl)-N-(1,3-thiazol-2-ylmethyl)acetamide
CID 110463122
N-[[4-(2-aminoethyl)phenyl]methyl]-2-thiophen-2-ylacetamide
CID 62502320
3,3-dimethyl-N-(thiophen-2-ylmethyl)butanamide
CID 1246126
5-oxo-5-[4-[2-oxo-2-(thiophen-2-ylmethylamino)ethyl]anilino]-3-thiophen-2-ylpentanoic acid
CID 71798241

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide?
The IUPAC name of 2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide (CID 78806113) is 2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide.
What is the SMILES notation for 2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide?
The canonical SMILES for 2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide is O=C(Cc1ccc(O)cc1)NCc1cccs1.
What is the InChIKey of 2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide?
The InChIKey is FUTXPTAAOYLPKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13NO2S/c15-11-5-3-10(4-6-11)8-13(16)14-9-12-2-1-7-17-12/h1-7,15H,8-9H2,(H,14,16).
What are the key properties of 2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide?
2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide has a molecular weight of 247.32 g/mol, XLogP of 2.31, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxyphenyl)-N-(thiophen-2-ylmethyl)acetamide is sourced from PubChem (CID 78806113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).