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

C17H18O2 — CID 62389764

IUPAC1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone
SMILESCCOc1ccc(C(=O)Cc2cccc(C)c2)cc1
InChIInChI=1S/C17H18O2/c1-3-19-16-9-7-15(8-10-16)17(18)12-14-6-4-5-13(2)11-14/h4-11H,3,12H2,1-2H3
InChIKeyFSVZOEYGITZHLF-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.82
Rot. Bonds5

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

1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone (PubChem CID 62389764) has the molecular formula C17H18O2 and a molecular weight of 254.33 g/mol. Its IUPAC name is 1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone.

Molecular Properties

Compound Name1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone
PubChem CID62389764
Molecular FormulaC17H18O2
Molecular Weight254.33 g/mol
Exact Mass254.13
IUPAC Name1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone
SMILESCCOc1ccc(C(=O)Cc2cccc(C)c2)cc1
InChIInChI=1S/C17H18O2/c1-3-19-16-9-7-15(8-10-16)17(18)12-14-6-4-5-13(2)11-14/h4-11H,3,12H2,1-2H3
InChIKeyFSVZOEYGITZHLF-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-methylphenyl)-1-[4-(trifluoromethoxy)phenyl]ethanone
CID 115736451
N-[2-(4-ethoxyphenoxy)ethyl]-2-(3-methylphenyl)acetamide
CID 30350207
1-(3,4-difluorophenyl)-2-(3-methylphenyl)ethanone
CID 60797589
1-(4-ethoxyphenyl)-3-(4-methylphenyl)propane-1,3-dione
CID 18428766
1,8-bis(4-ethoxyphenyl)octane-1,8-dione
CID 3098381
N-(4-ethoxyphenyl)-3-[(3-methylphenyl)methylamino]propanamide
CID 109019679
1-(3-fluoro-4-methoxyphenyl)-2-(3-methylphenyl)ethanone
CID 62389398
1-[4-[(3-methylphenyl)methoxy]phenyl]-2-propan-2-ylsulfanylethanone
CID 82051791
3-(3-methylphenyl)-1-(4-methylphenyl)propan-1-one
CID 24725664
1-(4-butoxyphenyl)-2-(4-methylphenyl)ethanone
CID 63527517
2-(3-methylphenyl)-1-(5-methylthiophen-3-yl)ethanone
CID 65099524
1-(4-methylphenyl)-2-(4-propoxyphenyl)ethanone
CID 143603704

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone?
The IUPAC name of 1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone (CID 62389764) is 1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone.
What is the SMILES notation for 1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone?
The canonical SMILES for 1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone is CCOc1ccc(C(=O)Cc2cccc(C)c2)cc1.
What is the InChIKey of 1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone?
The InChIKey is FSVZOEYGITZHLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18O2/c1-3-19-16-9-7-15(8-10-16)17(18)12-14-6-4-5-13(2)11-14/h4-11H,3,12H2,1-2H3.
What are the key properties of 1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone?
1-(4-ethoxyphenyl)-2-(3-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 1-(4-ethoxyphenyl)-2-(3-methylphenyl)ethanone is sourced from PubChem (CID 62389764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).