1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone

C18H20O3 — CID 43799191

IUPAC1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone
SMILESCCOc1ccccc1C(=O)COc1cccc(CC)c1
InChIInChI=1S/C18H20O3/c1-3-14-8-7-9-15(12-14)21-13-17(19)16-10-5-6-11-18(16)20-4-2/h5-12H,3-4,13H2,1-2H3
InChIKeyHPXVAUHPBNGNNJ-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.91
Rot. Bonds7

About 1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone

1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone (PubChem CID 43799191) has the molecular formula C18H20O3 and a molecular weight of 284.36 g/mol. Its IUPAC name is 1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone.

Molecular Properties

Compound Name1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone
PubChem CID43799191
Molecular FormulaC18H20O3
Molecular Weight284.36 g/mol
Exact Mass284.14
IUPAC Name1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone
SMILESCCOc1ccccc1C(=O)COc1cccc(CC)c1
InChIInChI=1S/C18H20O3/c1-3-14-8-7-9-15(12-14)21-13-17(19)16-10-5-6-11-18(16)20-4-2/h5-12H,3-4,13H2,1-2H3
InChIKeyHPXVAUHPBNGNNJ-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

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Related Compounds

1-(2-ethoxyphenyl)-2-[4-(hydroxymethyl)phenoxy]ethanone
CID 61229921
2-(4-bromophenoxy)-1-(2-ethoxyphenyl)ethanone
CID 62029870
1-(2-ethoxyphenyl)-2-(4-methylsulfanylphenoxy)ethanone
CID 63649372
2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone
CID 43411800
2-(3-bromo-5-fluorophenoxy)-1-(2-ethoxyphenyl)ethanone
CID 81315134
2-[(3-bromophenyl)methoxy]-1-(2-ethoxyphenyl)ethanone
CID 82808702
(2-tert-butylphenyl) 2-(3-ethylphenoxy)acetate
CID 19179473
1-(2-ethoxyphenyl)-2-(2-fluoro-3-methylphenoxy)ethanone
CID 107659470
3-(2-ethoxy-5-ethylphenyl)-1-(2-ethoxyphenyl)propan-1-one
CID 70018291
2-(3-ethylphenoxy)benzoyl bromide
CID 139662785
2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone
CID 62338272
2-(3-ethylphenoxy)-N-methylacetohydrazide
CID 116820496

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone?
The IUPAC name of 1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone (CID 43799191) is 1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone.
What is the SMILES notation for 1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone?
The canonical SMILES for 1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone is CCOc1ccccc1C(=O)COc1cccc(CC)c1.
What is the InChIKey of 1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone?
The InChIKey is HPXVAUHPBNGNNJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O3/c1-3-14-8-7-9-15(12-14)21-13-17(19)16-10-5-6-11-18(16)20-4-2/h5-12H,3-4,13H2,1-2H3.
What are the key properties of 1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone?
1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)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 1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone is sourced from PubChem (CID 43799191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).