2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone

C18H20O2 — CID 43799719

IUPAC2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone
SMILESCCc1ccc(C(=O)COc2c(C)cccc2C)cc1
InChIInChI=1S/C18H20O2/c1-4-15-8-10-16(11-9-15)17(19)12-20-18-13(2)6-5-7-14(18)3/h5-11H,4,12H2,1-3H3
InChIKeyWIKOGWFBKDDRLV-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.13
Rot. Bonds5

About 2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone

2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone (PubChem CID 43799719) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone.

Molecular Properties

Compound Name2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone
PubChem CID43799719
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone
SMILESCCc1ccc(C(=O)COc2c(C)cccc2C)cc1
InChIInChI=1S/C18H20O2/c1-4-15-8-10-16(11-9-15)17(19)12-20-18-13(2)6-5-7-14(18)3/h5-11H,4,12H2,1-3H3
InChIKeyWIKOGWFBKDDRLV-UHFFFAOYSA-N
XLogP4.13
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-(4-ethylphenyl)-2-(2-fluoro-3-methylphenoxy)ethanone
CID 107659479
2-(2,6-dimethylphenoxy)-1-[4-(trifluoromethyl)phenyl]ethanone
CID 139247580
2-(3-ethoxyphenoxy)-1-(4-ethylphenyl)ethanone
CID 62338272
1-(4-methylphenyl)-2-(2,4,6-trimethylphenoxy)ethanone
CID 63566170
2-(3-ethylphenoxy)-1-(4-methylphenyl)ethanone
CID 43411800
2-(2,6-dichlorophenoxy)-1-(4-propylphenyl)ethanone
CID 60626549
[2-(4-ethylphenyl)-2-oxoethyl] 4-methylbenzoate
CID 902784
2-(2,5-dichlorophenoxy)-1-(4-ethylphenyl)ethanone
CID 60623167
2-(2-bromo-4-ethylphenoxy)-N'-[2-(2,6-dimethylphenoxy)acetyl]acetohydrazide
CID 4504195
N'-[2-(2,6-dimethylphenoxy)acetyl]-4-(4-ethoxyphenyl)-4-oxobutanehydrazide
CID 4816885
1-(4-fluorophenyl)-2-(2,3,6-trimethylphenoxy)ethanone
CID 43224754
1-(4-bromophenyl)-2-(2,3,6-trimethylphenoxy)ethanone
CID 43425734

Frequently Asked Questions

What is the IUPAC name of 2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone?
The IUPAC name of 2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone (CID 43799719) is 2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone.
What is the SMILES notation for 2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone?
The canonical SMILES for 2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone is CCc1ccc(C(=O)COc2c(C)cccc2C)cc1.
What is the InChIKey of 2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone?
The InChIKey is WIKOGWFBKDDRLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-4-15-8-10-16(11-9-15)17(19)12-20-18-13(2)6-5-7-14(18)3/h5-11H,4,12H2,1-3H3.
What are the key properties of 2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone?
2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone has a molecular weight of 268.36 g/mol, XLogP of 4.13, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,6-dimethylphenoxy)-1-(4-ethylphenyl)ethanone is sourced from PubChem (CID 43799719), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).