2-(3-fluorophenyl)-1-quinolin-6-ylethanone

C17H12FNO — CID 63096139

IUPAC2-(3-fluorophenyl)-1-quinolin-6-ylethanone
SMILESO=C(Cc1cccc(F)c1)c1ccc2ncccc2c1
InChIInChI=1S/C17H12FNO/c18-15-5-1-3-12(9-15)10-17(20)14-6-7-16-13(11-14)4-2-8-19-16/h1-9,11H,10H2
InChIKeyZOTTZUKEYYHZOK-UHFFFAOYSA-N
MW265.29 g/mol
LogP3.80
Rot. Bonds3

About 2-(3-fluorophenyl)-1-quinolin-6-ylethanone

2-(3-fluorophenyl)-1-quinolin-6-ylethanone (PubChem CID 63096139) has the molecular formula C17H12FNO and a molecular weight of 265.29 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-1-quinolin-6-ylethanone.

Molecular Properties

Compound Name2-(3-fluorophenyl)-1-quinolin-6-ylethanone
PubChem CID63096139
Molecular FormulaC17H12FNO
Molecular Weight265.29 g/mol
Exact Mass265.09
IUPAC Name2-(3-fluorophenyl)-1-quinolin-6-ylethanone
SMILESO=C(Cc1cccc(F)c1)c1ccc2ncccc2c1
InChIInChI=1S/C17H12FNO/c18-15-5-1-3-12(9-15)10-17(20)14-6-7-16-13(11-14)4-2-8-19-16/h1-9,11H,10H2
InChIKeyZOTTZUKEYYHZOK-UHFFFAOYSA-N
XLogP3.80
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.29
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-bromo-5-fluorophenyl)-1-quinolin-6-ylethanone
CID 79699269
2-(4-methylphenyl)-1-quinolin-6-ylethanone
CID 63096314
2-(3-fluorophenyl)-1-pyridin-3-ylethanone
CID 60797988
1-(3-bromophenyl)-2-(3-fluorophenyl)ethanone
CID 24723944
5-amino-1-quinolin-6-ylpentan-1-one
CID 116572003
2-(3-fluorophenyl)-1-(4-sulfanylphenyl)ethanone
CID 155354849
2-(methylamino)-1-quinolin-6-ylethanone
CID 84669481
1-[2-(2,6-dichlorophenyl)-3H-benzimidazol-5-yl]-2-quinolin-6-ylethanone
CID 58156343
N-[(4-fluorophenyl)methyl]quinoline-6-carboxamide
CID 59192191
2-(3-fluorophenyl)-1-(3-methoxyphenyl)ethanone
CID 60797583
2-(3-fluorophenyl)-1-quinolin-4-ylethanone
CID 105080568
2-(2-amino-1,3-thiazol-4-yl)-1-quinolin-6-ylethanone
CID 116575719

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-1-quinolin-6-ylethanone?
The IUPAC name of 2-(3-fluorophenyl)-1-quinolin-6-ylethanone (CID 63096139) is 2-(3-fluorophenyl)-1-quinolin-6-ylethanone.
What is the SMILES notation for 2-(3-fluorophenyl)-1-quinolin-6-ylethanone?
The canonical SMILES for 2-(3-fluorophenyl)-1-quinolin-6-ylethanone is O=C(Cc1cccc(F)c1)c1ccc2ncccc2c1.
What is the InChIKey of 2-(3-fluorophenyl)-1-quinolin-6-ylethanone?
The InChIKey is ZOTTZUKEYYHZOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12FNO/c18-15-5-1-3-12(9-15)10-17(20)14-6-7-16-13(11-14)4-2-8-19-16/h1-9,11H,10H2.
What are the key properties of 2-(3-fluorophenyl)-1-quinolin-6-ylethanone?
2-(3-fluorophenyl)-1-quinolin-6-ylethanone has a molecular weight of 265.29 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-1-quinolin-6-ylethanone is sourced from PubChem (CID 63096139), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).