1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone

C18H19FO — CID 81274461

IUPAC1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone
SMILESCc1cc(F)ccc1C(=O)Cc1ccc(C(C)C)cc1
InChIInChI=1S/C18H19FO/c1-12(2)15-6-4-14(5-7-15)11-18(20)17-9-8-16(19)10-13(17)3/h4-10,12H,11H2,1-3H3
InChIKeyBKEPJOQRMPVIQM-UHFFFAOYSA-N
MW270.35 g/mol
LogP4.68
Rot. Bonds4

About 1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone

1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone (PubChem CID 81274461) has the molecular formula C18H19FO and a molecular weight of 270.35 g/mol. Its IUPAC name is 1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone.

Molecular Properties

Compound Name1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone
PubChem CID81274461
Molecular FormulaC18H19FO
Molecular Weight270.35 g/mol
Exact Mass270.14
IUPAC Name1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone
SMILESCc1cc(F)ccc1C(=O)Cc1ccc(C(C)C)cc1
InChIInChI=1S/C18H19FO/c1-12(2)15-6-4-14(5-7-15)11-18(20)17-9-8-16(19)10-13(17)3/h4-10,12H,11H2,1-3H3
InChIKeyBKEPJOQRMPVIQM-UHFFFAOYSA-N
XLogP4.68
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 ≤ 54.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-amino-5-fluorophenyl)-2-(4-propan-2-ylphenyl)ethanone
CID 82685660
1-(4-fluoro-2-methylphenyl)-2-[4-(2-fluoropropan-2-yloxy)phenyl]ethanone
CID 144675666
3-(4-aminophenyl)-1-(4-fluoro-2-methylphenyl)butan-1-one
CID 116612864
1-(4-fluoro-2-methylphenyl)-2-(furan-3-yl)ethanone
CID 83171971
1-(2,4-difluorophenyl)-2-(4-methylphenyl)ethanone
CID 43337683
2-(3-bromo-4-methoxyphenyl)-1-(4-fluoro-2-methylphenyl)ethanone
CID 81273091
1-(4-fluoro-2-methylphenyl)-2-propan-2-ylsulfanylethanone
CID 65134273
1-(2-chloro-4-fluorophenyl)-2-(4-ethylphenyl)ethanone
CID 63410277
1-(2-chloro-3-fluorophenyl)-2-(4-propan-2-ylphenyl)ethanone
CID 114968326
2-(5-bromo-2-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanone
CID 81274265
2-(3-chloro-2-fluorophenyl)-1-(4-fluoro-2-methylphenyl)ethanone
CID 82803043
1-(5-fluoro-2-methylphenyl)-2-(4-iodophenyl)ethanone
CID 65477472

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone?
The IUPAC name of 1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone (CID 81274461) is 1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone.
What is the SMILES notation for 1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone?
The canonical SMILES for 1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone is Cc1cc(F)ccc1C(=O)Cc1ccc(C(C)C)cc1.
What is the InChIKey of 1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone?
The InChIKey is BKEPJOQRMPVIQM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19FO/c1-12(2)15-6-4-14(5-7-15)11-18(20)17-9-8-16(19)10-13(17)3/h4-10,12H,11H2,1-3H3.
What are the key properties of 1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone?
1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone has a molecular weight of 270.35 g/mol, XLogP of 4.68, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluoro-2-methylphenyl)-2-(4-propan-2-ylphenyl)ethanone is sourced from PubChem (CID 81274461), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).