2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide

C16H19NO2S — CID 78963260

IUPAC2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide
SMILESCC(C)(CNC(=O)Cc1ccccc1O)c1cccs1
InChIInChI=1S/C16H19NO2S/c1-16(2,14-8-5-9-20-14)11-17-15(19)10-12-6-3-4-7-13(12)18/h3-9,18H,10-11H2,1-2H3,(H,17,19)
InChIKeyJEDDWPGFDJTMGT-UHFFFAOYSA-N
MW289.40 g/mol
LogP3.09
Rot. Bonds5

About 2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide

2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide (PubChem CID 78963260) has the molecular formula C16H19NO2S and a molecular weight of 289.40 g/mol. Its IUPAC name is 2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide
PubChem CID78963260
Molecular FormulaC16H19NO2S
Molecular Weight289.40 g/mol
Exact Mass289.11
IUPAC Name2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide
SMILESCC(C)(CNC(=O)Cc1ccccc1O)c1cccs1
InChIInChI=1S/C16H19NO2S/c1-16(2,14-8-5-9-20-14)11-17-15(19)10-12-6-3-4-7-13(12)18/h3-9,18H,10-11H2,1-2H3,(H,17,19)
InChIKeyJEDDWPGFDJTMGT-UHFFFAOYSA-N
XLogP3.09
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.40
LogP ≤ 53.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[2-(aminomethyl)phenyl]-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide
CID 81312766
N-(2-methyl-2-thiophen-2-ylpropyl)-N'-(2,2,2-trifluoroethyl)propanediamide
CID 75451079
3-(2-hydroxyphenyl)-N-(2-hydroxy-2-thiophen-2-ylpropyl)propanamide
CID 111442061
4-[(2-methyl-2-thiophen-2-ylpropyl)carbamoyl]benzoic acid
CID 80524374
5-amino-N-(2-methyl-2-thiophen-2-ylpropyl)pentanamide
CID 80527343
2-(5-amino-2-pyridinyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide
CID 107339275
(2R)-2-amino-N-(2-methyl-2-thiophen-2-ylpropyl)-2-phenylacetamide
CID 80527246
N-(2-methyl-2-thiophen-2-ylpropyl)-2-propoxyacetamide
CID 113236235
2-(1-aminocyclobutyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide
CID 80527308
ethyl 4-[(2-methyl-2-thiophen-2-ylpropyl)amino]-4-oxobutanoate
CID 78962055
2,2-dimethyl-3-[(2-methyl-2-thiophen-2-ylpropyl)amino]-3-oxopropanoic acid
CID 82821603
2-methyl-4-[(2-methyl-2-thiophen-2-ylpropyl)amino]-4-oxo-2-propan-2-ylbutanoic acid
CID 80526378

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide?
The IUPAC name of 2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide (CID 78963260) is 2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide.
What is the SMILES notation for 2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide?
The canonical SMILES for 2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide is CC(C)(CNC(=O)Cc1ccccc1O)c1cccs1.
What is the InChIKey of 2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide?
The InChIKey is JEDDWPGFDJTMGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO2S/c1-16(2,14-8-5-9-20-14)11-17-15(19)10-12-6-3-4-7-13(12)18/h3-9,18H,10-11H2,1-2H3,(H,17,19).
What are the key properties of 2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide?
2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide has a molecular weight of 289.40 g/mol, XLogP of 3.09, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenyl)-N-(2-methyl-2-thiophen-2-ylpropyl)acetamide is sourced from PubChem (CID 78963260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).