2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone

C18H20O3 — CID 62338272

IUPAC2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone
SMILESCCOc1cccc(OCC(=O)c2ccc(CC)cc2)c1
InChIInChI=1S/C18H20O3/c1-3-14-8-10-15(11-9-14)18(19)13-21-17-7-5-6-16(12-17)20-4-2/h5-12H,3-4,13H2,1-2H3
InChIKeyUJTHZYNEXMZNDG-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.91
Rot. Bonds7

About 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone

2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone (PubChem CID 62338272) has the molecular formula C18H20O3 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone.

Molecular Properties

Compound Name2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone
PubChem CID62338272
Molecular FormulaC18H20O3
Molecular Weight284.36 g/mol
Exact Mass284.14
IUPAC Name2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone
SMILESCCOc1cccc(OCC(=O)c2ccc(CC)cc2)c1
InChIInChI=1S/C18H20O3/c1-3-14-8-10-15(11-9-14)18(19)13-21-17-7-5-6-16(12-17)20-4-2/h5-12H,3-4,13H2,1-2H3
InChIKeyUJTHZYNEXMZNDG-UHFFFAOYSA-N
XLogP3.91
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone 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

1-(4-bromophenyl)-2-(3-ethoxyphenoxy)ethanone
CID 62337475
2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone
CID 43411800
2-(3-ethylphenoxy)-1-(4-propan-2-ylphenyl)ethanone
CID 43411799
1-(4-ethoxyphenyl)-3-(4-ethylphenyl)propane-1,3-dione
CID 18428768
2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone
CID 43799719
2-(4-chlorophenoxy)-1-(3-ethoxyphenyl)ethanone
CID 105122407
1-(2,4-dimethylphenyl)-2-(3-ethoxyphenoxy)ethanone
CID 62338468
1-(4-chlorophenyl)-2-(3-methoxyphenoxy)ethanone
CID 43412672
2-(3-butoxyphenoxy)-1-phenylethanone
CID 15692245
2-(3-fluorophenoxy)-1-(4-methoxyphenyl)ethanone
CID 43413421
1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone
CID 43799191
2-(3-bromo-5-fluorophenoxy)-1-(4-ethylphenyl)ethanone
CID 81331658

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone?
The IUPAC name of 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone (CID 62338272) is 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone.
What is the SMILES notation for 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone?
The canonical SMILES for 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone is CCOc1cccc(OCC(=O)c2ccc(CC)cc2)c1.
What is the InChIKey of 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone?
The InChIKey is UJTHZYNEXMZNDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O3/c1-3-14-8-10-15(11-9-14)18(19)13-21-17-7-5-6-16(12-17)20-4-2/h5-12H,3-4,13H2,1-2H3.
What are the key properties of 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone?
2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone has a molecular weight of 284.36 g/mol, XLogP of 3.91, 7 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone is sourced from PubChem (CID 62338272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).