1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one

C20H15FN2O — CID 168800789

IUPAC1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one
SMILESO=C1CCN(c2ccc(F)cc2)c2cc(-c3ccncc3)ccc21
InChIInChI=1S/C20H15FN2O/c21-16-2-4-17(5-3-16)23-12-9-20(24)18-6-1-15(13-19(18)23)14-7-10-22-11-8-14/h1-8,10-11,13H,9,12H2
InChIKeyDRWGURQNVWTGHL-UHFFFAOYSA-N
MW318.35 g/mol
LogP4.61
Rot. Bonds2

About 1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one

1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one (PubChem CID 168800789) has the molecular formula C20H15FN2O and a molecular weight of 318.35 g/mol. Its IUPAC name is 1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one.

Molecular Properties

Compound Name1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one
PubChem CID168800789
Molecular FormulaC20H15FN2O
Molecular Weight318.35 g/mol
Exact Mass318.12
IUPAC Name1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one
SMILESO=C1CCN(c2ccc(F)cc2)c2cc(-c3ccncc3)ccc21
InChIInChI=1S/C20H15FN2O/c21-16-2-4-17(5-3-16)23-12-9-20(24)18-6-1-15(13-19(18)23)14-7-10-22-11-8-14/h1-8,10-11,13H,9,12H2
InChIKeyDRWGURQNVWTGHL-UHFFFAOYSA-N
XLogP4.61
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.35
LogP ≤ 54.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-fluorophenyl)-2-pyridin-4-yl-6,7-dihydro-5H-indolizin-8-one
CID 59988451
1-[3-(2-oxopyrrolidin-1-yl)-5-(4-pyridin-4-ylphenyl)phenyl]pyrrolidin-2-one
CID 172517099
7-methyl-3-pyridin-4-yl-6,7,8,9-tetrahydrobenzo[7]annulen-5-one
CID 166240128
1-[4,5-bis(2-oxoaziridin-1-yl)-2-pyridin-4-ylphenyl]aziridin-2-one
CID 172517236
1-(4-fluorophenyl)-2,3-dihydroindole-6-carbaldehyde
CID 122476442
9-(4-fluorophenyl)-7-pyridin-4-yl-1,2-dihydropyrazolo[3,4-b]quinoline-3,4-dione
CID 10067863
4-(4-fluorophenyl)-1-(4-methylsulfinylphenyl)-3-pyridin-4-yl-2H-pyrrol-5-one
CID 160588547
9-[4-[4-[3,6-bis(4-fluorophenyl)carbazol-9-yl]phenyl]phenyl]-3,6-bis(4-fluorophenyl)carbazole
CID 23534185
4-pyridin-4-yl-1,4-diazepan-5-one
CID 115100494
1-(4-fluorophenyl)-3-nitro-7-pyridin-4-ylquinolin-4-one
CID 139685137
2-(4-fluorophenyl)-6-methoxy-3,4-dihydroisoquinolin-1-one
CID 10869393
1-[4-(4-methyl-5-pyridin-4-yl-3-pyridinyl)phenyl]pyrrolidin-2-one
CID 146769068

Frequently Asked Questions

What is the IUPAC name of 1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one?
The IUPAC name of 1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one (CID 168800789) is 1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one.
What is the SMILES notation for 1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one?
The canonical SMILES for 1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one is O=C1CCN(c2ccc(F)cc2)c2cc(-c3ccncc3)ccc21.
What is the InChIKey of 1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one?
The InChIKey is DRWGURQNVWTGHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15FN2O/c21-16-2-4-17(5-3-16)23-12-9-20(24)18-6-1-15(13-19(18)23)14-7-10-22-11-8-14/h1-8,10-11,13H,9,12H2.
What are the key properties of 1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one?
1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one has a molecular weight of 318.35 g/mol, XLogP of 4.61, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-fluorophenyl)-7-pyridin-4-yl-2,3-dihydroquinolin-4-one is sourced from PubChem (CID 168800789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).