6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one

C24H27FN2O2 — CID 46866223

IUPAC6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2cc(OC3CCN(C4CCC4)CC3)ccc2N1c1ccc(F)cc1
InChIInChI=1S/C24H27FN2O2/c25-18-5-7-20(8-6-18)27-23-10-9-22(16-17(23)4-11-24(27)28)29-21-12-14-26(15-13-21)19-2-1-3-19/h5-10,16,19,21H,1-4,11-15H2
InChIKeyOGDURQVZEFLQSR-UHFFFAOYSA-N
MW394.49 g/mol
LogP4.83
Rot. Bonds4

About 6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one

6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one (PubChem CID 46866223) has the molecular formula C24H27FN2O2 and a molecular weight of 394.49 g/mol. Its IUPAC name is 6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one
PubChem CID46866223
Molecular FormulaC24H27FN2O2
Molecular Weight394.49 g/mol
Exact Mass394.21
IUPAC Name6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2cc(OC3CCN(C4CCC4)CC3)ccc2N1c1ccc(F)cc1
InChIInChI=1S/C24H27FN2O2/c25-18-5-7-20(8-6-18)27-23-10-9-22(16-17(23)4-11-24(27)28)29-21-12-14-26(15-13-21)19-2-1-3-19/h5-10,16,19,21H,1-4,11-15H2
InChIKeyOGDURQVZEFLQSR-UHFFFAOYSA-N
XLogP4.83
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500394.49
LogP ≤ 54.83
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one?
The IUPAC name of 6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one (CID 46866223) is 6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one is O=C1CCc2cc(OC3CCN(C4CCC4)CC3)ccc2N1c1ccc(F)cc1.
What is the InChIKey of 6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one?
The InChIKey is OGDURQVZEFLQSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H27FN2O2/c25-18-5-7-20(8-6-18)27-23-10-9-22(16-17(23)4-11-24(27)28)29-21-12-14-26(15-13-21)19-2-1-3-19/h5-10,16,19,21H,1-4,11-15H2.
What are the key properties of 6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one?
6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one has a molecular weight of 394.49 g/mol, XLogP of 4.83, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-cyclobutylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 46866223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).