1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one

C18H19FO — CID 64759583

IUPAC1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one
SMILESCCc1ccc(C(=O)C(C)(C)c2ccc(F)cc2)cc1
InChIInChI=1S/C18H19FO/c1-4-13-5-7-14(8-6-13)17(20)18(2,3)15-9-11-16(19)12-10-15/h5-12H,4H2,1-3H3
InChIKeyYQMUDRXHFKWRKY-UHFFFAOYSA-N
MW270.35 g/mol
LogP4.55
Rot. Bonds4

About 1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one

1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one (PubChem CID 64759583) has the molecular formula C18H19FO and a molecular weight of 270.35 g/mol. Its IUPAC name is 1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one.

Molecular Properties

Compound Name1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one
PubChem CID64759583
Molecular FormulaC18H19FO
Molecular Weight270.35 g/mol
Exact Mass270.14
IUPAC Name1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one
SMILESCCc1ccc(C(=O)C(C)(C)c2ccc(F)cc2)cc1
InChIInChI=1S/C18H19FO/c1-4-13-5-7-14(8-6-13)17(20)18(2,3)15-9-11-16(19)12-10-15/h5-12H,4H2,1-3H3
InChIKeyYQMUDRXHFKWRKY-UHFFFAOYSA-N
XLogP4.55
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 54.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1,2-bis(4-fluorophenyl)-2-methylpropan-1-one
CID 64757736
1-(3,5-difluorophenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one
CID 64759777
2-(4-ethylsulfanylphenyl)-N-[4-[1-(4-fluorophenyl)-2-methyl-1-oxopropan-2-yl]phenyl]acetamide
CID 145231841
1-(4-ethylphenyl)-2-(4-fluorophenyl)sulfinylpropan-1-one
CID 64635745
2-(4-fluorophenyl)-1-(furan-3-yl)-2-methylpropan-1-one
CID 64759760
2-[4-[(4-fluorophenyl)methyl]phenyl]-2-methylpropanamide
CID 70707919
2,2,2-trichloro-1-(4-ethylphenyl)ethanone
CID 11054111
2-(ethylamino)-1-(4-fluorophenyl)-2-methylpropan-1-one
CID 116566054
2-bromo-1-(4-fluorophenyl)-2-methylpropan-1-one
CID 13113175
2,2-difluoro-1-(4-fluorophenyl)-2-(4-pentylphenyl)ethanone
CID 14993513
1-(4-ethylphenyl)-2-[(4-fluorophenyl)methylamino]propan-1-one
CID 82100239
2-(4-fluorophenyl)-1-[4-(2-methylbutan-2-yl)phenyl]ethanone
CID 66245946

Frequently Asked Questions

What is the IUPAC name of 1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one?
The IUPAC name of 1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one (CID 64759583) is 1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one.
What is the SMILES notation for 1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one?
The canonical SMILES for 1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one is CCc1ccc(C(=O)C(C)(C)c2ccc(F)cc2)cc1.
What is the InChIKey of 1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one?
The InChIKey is YQMUDRXHFKWRKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FO/c1-4-13-5-7-14(8-6-13)17(20)18(2,3)15-9-11-16(19)12-10-15/h5-12H,4H2,1-3H3.
What are the key properties of 1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one?
1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one has a molecular weight of 270.35 g/mol, XLogP of 4.55, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-ethylphenyl)-2-(4-fluorophenyl)-2-methylpropan-1-one is sourced from PubChem (CID 64759583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).