2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide

C18H21NO3 — CID 78813413

IUPAC2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide
SMILESCC(C)C(NC(=O)COc1ccccc1O)c1ccccc1
InChIInChI=1S/C18H21NO3/c1-13(2)18(14-8-4-3-5-9-14)19-17(21)12-22-16-11-7-6-10-15(16)20/h3-11,13,18,20H,12H2,1-2H3,(H,19,21)
InChIKeyWCNAXYCPXXCJAA-UHFFFAOYSA-N
MW299.37 g/mol
LogP3.28
Rot. Bonds6

About 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide

2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide (PubChem CID 78813413) has the molecular formula C18H21NO3 and a molecular weight of 299.37 g/mol. Its IUPAC name is 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide.

Molecular Properties

Compound Name2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide
PubChem CID78813413
Molecular FormulaC18H21NO3
Molecular Weight299.37 g/mol
Exact Mass299.15
IUPAC Name2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide
SMILESCC(C)C(NC(=O)COc1ccccc1O)c1ccccc1
InChIInChI=1S/C18H21NO3/c1-13(2)18(14-8-4-3-5-9-14)19-17(21)12-22-16-11-7-6-10-15(16)20/h3-11,13,18,20H,12H2,1-2H3,(H,19,21)
InChIKeyWCNAXYCPXXCJAA-UHFFFAOYSA-N
XLogP3.28
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.37
LogP ≤ 53.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)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

N-[1-(4-ethylphenyl)-2-methylpropyl]-2-(2-hydroxyphenoxy)acetamide
CID 78810754
2-(2-methoxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide
CID 51213896
2-(2-ethoxyphenoxy)-N-[(1R)-2-methyl-1-phenylpropyl]acetamide
CID 9050837
2-(4-methoxyphenoxy)-N-[(1R)-2-methyl-1-phenylpropyl]acetamide
CID 9050798
2-(2-hydroxyphenoxy)-N-[(1S)-2-hydroxy-1-phenylethyl]acetamide
CID 103945081
2-[[2-(2-hydroxyphenoxy)acetyl]amino]-2-phenylacetamide
CID 78840056
2-(4-acetylphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide
CID 17453100
N-(2-methyl-1-phenylpropyl)-2-[(2-methylpropan-2-yl)oxy]acetamide
CID 112605048
N-[1-(4-ethylphenyl)-2-methylpropyl]-2-(2-fluorophenoxy)acetamide
CID 18268544
2-(2-hydroxyphenoxy)-N-(1-naphthalen-1-ylethyl)acetamide
CID 78777927
2-bromo-N-(2-methyl-1-phenylpropyl)acetamide
CID 10492239
2-naphthalen-1-yloxy-N-(1-phenylethyl)acetamide
CID 4513591

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide?
The IUPAC name of 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide (CID 78813413) is 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide.
What is the SMILES notation for 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide?
The canonical SMILES for 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide is CC(C)C(NC(=O)COc1ccccc1O)c1ccccc1.
What is the InChIKey of 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide?
The InChIKey is WCNAXYCPXXCJAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO3/c1-13(2)18(14-8-4-3-5-9-14)19-17(21)12-22-16-11-7-6-10-15(16)20/h3-11,13,18,20H,12H2,1-2H3,(H,19,21).
What are the key properties of 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide?
2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide has a molecular weight of 299.37 g/mol, XLogP of 3.28, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxyphenoxy)-N-(2-methyl-1-phenylpropyl)acetamide is sourced from PubChem (CID 78813413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).