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

C23H25FN2O2 — CID 46866330

IUPAC6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2cc(OC3CCN(C4CC4)CC3)ccc2N1c1ccc(F)cc1
InChIInChI=1S/C23H25FN2O2/c24-17-2-4-19(5-3-17)26-22-9-8-21(15-16(22)1-10-23(26)27)28-20-11-13-25(14-12-20)18-6-7-18/h2-5,8-9,15,18,20H,1,6-7,10-14H2
InChIKeyORDSGOPLNIRLBF-UHFFFAOYSA-N
MW380.46 g/mol
LogP4.44
Rot. Bonds4

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

6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one (PubChem CID 46866330) has the molecular formula C23H25FN2O2 and a molecular weight of 380.46 g/mol. Its IUPAC name is 6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one
PubChem CID46866330
Molecular FormulaC23H25FN2O2
Molecular Weight380.46 g/mol
Exact Mass380.19
IUPAC Name6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one
SMILESO=C1CCc2cc(OC3CCN(C4CC4)CC3)ccc2N1c1ccc(F)cc1
InChIInChI=1S/C23H25FN2O2/c24-17-2-4-19(5-3-17)26-22-9-8-21(15-16(22)1-10-23(26)27)28-20-11-13-25(14-12-20)18-6-7-18/h2-5,8-9,15,18,20H,1,6-7,10-14H2
InChIKeyORDSGOPLNIRLBF-UHFFFAOYSA-N
XLogP4.44
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.46
LogP ≤ 54.44
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one?
The IUPAC name of 6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one (CID 46866330) is 6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one?
The canonical SMILES for 6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one is O=C1CCc2cc(OC3CCN(C4CC4)CC3)ccc2N1c1ccc(F)cc1.
What is the InChIKey of 6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one?
The InChIKey is ORDSGOPLNIRLBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25FN2O2/c24-17-2-4-19(5-3-17)26-22-9-8-21(15-16(22)1-10-23(26)27)28-20-11-13-25(14-12-20)18-6-7-18/h2-5,8-9,15,18,20H,1,6-7,10-14H2.
What are the key properties of 6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one?
6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one has a molecular weight of 380.46 g/mol, XLogP of 4.44, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1-cyclopropylpiperidin-4-yl)oxy-1-(4-fluorophenyl)-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 46866330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).