1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone

C19H15FO — CID 63409453

IUPAC1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone
SMILESCc1ccc(F)cc1C(=O)Cc1cccc2ccccc12
InChIInChI=1S/C19H15FO/c1-13-9-10-16(20)12-18(13)19(21)11-15-7-4-6-14-5-2-3-8-17(14)15/h2-10,12H,11H2,1H3
InChIKeyQVTSBUAWWYHGBO-UHFFFAOYSA-N
MW278.33 g/mol
LogP4.71
Rot. Bonds3

About 1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone

1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone (PubChem CID 63409453) has the molecular formula C19H15FO and a molecular weight of 278.33 g/mol. Its IUPAC name is 1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone.

Molecular Properties

Compound Name1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone
PubChem CID63409453
Molecular FormulaC19H15FO
Molecular Weight278.33 g/mol
Exact Mass278.11
IUPAC Name1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone
SMILESCc1ccc(F)cc1C(=O)Cc1cccc2ccccc12
InChIInChI=1S/C19H15FO/c1-13-9-10-16(20)12-18(13)19(21)11-15-7-4-6-14-5-2-3-8-17(14)15/h2-10,12H,11H2,1H3
InChIKeyQVTSBUAWWYHGBO-UHFFFAOYSA-N
XLogP4.71
TPSA17.07 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.33
LogP ≤ 54.71
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-(2-bromo-4-fluorophenyl)-2-naphthalen-1-ylethanone
CID 63528898
2-(2,6-dichlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanone
CID 55187917
2-(3-chlorophenyl)-1-(5-fluoro-2-methylphenyl)ethanone
CID 62388067
1-(2-hydroxy-5-methylphenyl)-2-naphthalen-1-ylethanone
CID 155671739
1-(3,6-dimethylpyridazin-4-yl)-2-naphthalen-1-ylethanone
CID 105087972
1-(2,5-dimethylphenyl)-2-(2-fluorophenyl)ethanone
CID 43337245
2-(5-fluoro-2-methylphenyl)-1-(2-fluorophenyl)ethanone
CID 105373215
1-(2-amino-5-methylphenyl)-2-naphthalen-1-ylethanone
CID 116581294
(5-fluoro-2-methylphenyl)-isoquinolin-1-ylmethanone
CID 63948626
1-(2-ethylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone
CID 115812520
1-(5-fluoro-2-methylphenyl)-2-(4-iodophenyl)ethanone
CID 65477472
1-(2-bromo-5-fluorophenyl)-2-(5-fluoro-2-methylphenyl)ethanone
CID 105376889

Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone?
The IUPAC name of 1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone (CID 63409453) is 1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone.
What is the SMILES notation for 1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone?
The canonical SMILES for 1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone is Cc1ccc(F)cc1C(=O)Cc1cccc2ccccc12.
What is the InChIKey of 1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone?
The InChIKey is QVTSBUAWWYHGBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15FO/c1-13-9-10-16(20)12-18(13)19(21)11-15-7-4-6-14-5-2-3-8-17(14)15/h2-10,12H,11H2,1H3.
What are the key properties of 1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone?
1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone has a molecular weight of 278.33 g/mol, XLogP of 4.71, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-2-methylphenyl)-2-naphthalen-1-ylethanone is sourced from PubChem (CID 63409453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).