1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone

C17H17FO — CID 115812520

IUPAC1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone
SMILESCCc1ccccc1C(=O)Cc1ccc(F)cc1C
InChIInChI=1S/C17H17FO/c1-3-13-6-4-5-7-16(13)17(19)11-14-8-9-15(18)10-12(14)2/h4-10H,3,11H2,1-2H3
InChIKeyARWQBVXCHBVJTM-UHFFFAOYSA-N
MW256.32 g/mol
LogP4.12
Rot. Bonds4

About 1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone

1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone (PubChem CID 115812520) has the molecular formula C17H17FO and a molecular weight of 256.32 g/mol. Its IUPAC name is 1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone.

Molecular Properties

Compound Name1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone
PubChem CID115812520
Molecular FormulaC17H17FO
Molecular Weight256.32 g/mol
Exact Mass256.13
IUPAC Name1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone
SMILESCCc1ccccc1C(=O)Cc1ccc(F)cc1C
InChIInChI=1S/C17H17FO/c1-3-13-6-4-5-7-16(13)17(19)11-14-8-9-15(18)10-12(14)2/h4-10H,3,11H2,1-2H3
InChIKeyARWQBVXCHBVJTM-UHFFFAOYSA-N
XLogP4.12
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.32
LogP ≤ 54.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

2-(4-fluoro-2-methylphenyl)-1-phenylethanone
CID 114347156
1-(2-chloro-3-fluorophenyl)-2-(4-fluoro-2-methylphenyl)ethanone
CID 115812505
1-(3-bromo-2-chlorophenyl)-2-(4-fluoro-2-methylphenyl)ethanone
CID 115812770
1-(2-fluoro-4-methylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone
CID 115812673
1-(2,5-dimethylfuran-3-yl)-2-(4-fluoro-2-methylphenyl)ethanone
CID 115812715
2-(4-fluoro-2-methylphenyl)acetic acid
CID 5016950
ethane;1-ethyl-4-fluoro-2-methylbenzene
CID 143471886
2-(5-fluoro-2-methylphenyl)-1-(2-fluorophenyl)ethanone
CID 105373215
1-(4-fluoro-2-methylphenyl)-2-(2-methoxyphenyl)ethanone
CID 62790793
1-(4-bromo-2-fluorophenyl)-2-(4-fluoro-2-methylphenyl)ethanone
CID 114905857
2-(3,5-dimethylphenyl)-1-(2-ethylphenyl)ethanone
CID 114963222
1,2-bis(2-methylphenyl)ethanone
CID 11345119

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone?
The IUPAC name of 1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone (CID 115812520) is 1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone.
What is the SMILES notation for 1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone?
The canonical SMILES for 1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone is CCc1ccccc1C(=O)Cc1ccc(F)cc1C.
What is the InChIKey of 1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone?
The InChIKey is ARWQBVXCHBVJTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17FO/c1-3-13-6-4-5-7-16(13)17(19)11-14-8-9-15(18)10-12(14)2/h4-10H,3,11H2,1-2H3.
What are the key properties of 1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone?
1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone has a molecular weight of 256.32 g/mol, XLogP of 4.12, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone is sourced from PubChem (CID 115812520), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).