2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone

C17H18O2 — CID 43411800

IUPAC2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone
SMILESCCc1cccc(OCC(=O)c2ccc(C)cc2)c1
InChIInChI=1S/C17H18O2/c1-3-14-5-4-6-16(11-14)19-12-17(18)15-9-7-13(2)8-10-15/h4-11H,3,12H2,1-2H3
InChIKeyGQEZARCRTCEEJO-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.82
Rot. Bonds5

About 2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone

2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone (PubChem CID 43411800) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone.

Molecular Properties

Compound Name2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone
PubChem CID43411800
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone
SMILESCCc1cccc(OCC(=O)c2ccc(C)cc2)c1
InChIInChI=1S/C17H18O2/c1-3-14-5-4-6-16(11-14)19-12-17(18)15-9-7-13(2)8-10-15/h4-11H,3,12H2,1-2H3
InChIKeyGQEZARCRTCEEJO-UHFFFAOYSA-N
XLogP3.82
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-ethylphenoxy)-1-(4-propan-2-ylphenyl)ethanone
CID 43411799
2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone
CID 62338272
3-(3-ethylphenoxy)-1-phenylpropan-1-one
CID 116692020
1-(2-ethoxyphenyl)-2-(3-ethylphenoxy)ethanone
CID 43799191
2-(3,4-difluorophenoxy)-1-(4-methylphenyl)ethanone
CID 43612523
2-(3-ethylphenoxy)-N'-methylacetohydrazide
CID 116820670
2-(3-ethylphenoxy)-N-methylacetohydrazide
CID 116820496
1-(4-bromophenyl)-2-(3-ethoxyphenoxy)ethanone
CID 62337475
N'-acetyl-2-(3-ethylphenoxy)acetohydrazide
CID 43011736
propyl 2-(3-ethylphenoxy)acetate
CID 71628037
N-[4-[2-(3-methylphenoxy)acetyl]phenyl]acetamide
CID 167959701
2-(4-acetylphenoxy)-1-(4-methylphenyl)ethanone
CID 60625443

Frequently Asked Questions

What is the IUPAC name of 2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone?
The IUPAC name of 2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone (CID 43411800) is 2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone.
What is the SMILES notation for 2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone?
The canonical SMILES for 2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone is CCc1cccc(OCC(=O)c2ccc(C)cc2)c1.
What is the InChIKey of 2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone?
The InChIKey is GQEZARCRTCEEJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c1-3-14-5-4-6-16(11-14)19-12-17(18)15-9-7-13(2)8-10-15/h4-11H,3,12H2,1-2H3.
What are the key properties of 2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone?
2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone has a molecular weight of 254.33 g/mol, XLogP of 3.82, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone is sourced from PubChem (CID 43411800), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).