1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one

C18H16N2O2 — CID 66967300

IUPAC1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one
SMILESO=C1CCN(N2CCC(=O)c3ccccc32)c2ccccc21
InChIInChI=1S/C18H16N2O2/c21-17-9-11-19(15-7-3-1-5-13(15)17)20-12-10-18(22)14-6-2-4-8-16(14)20/h1-8H,9-12H2
InChIKeyMKMKMRZOTLYQHQ-UHFFFAOYSA-N
MW292.34 g/mol
LogP3.09
Rot. Bonds1

About 1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one

1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one (PubChem CID 66967300) has the molecular formula C18H16N2O2 and a molecular weight of 292.34 g/mol. Its IUPAC name is 1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one.

Molecular Properties

Compound Name1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one
PubChem CID66967300
Molecular FormulaC18H16N2O2
Molecular Weight292.34 g/mol
Exact Mass292.12
IUPAC Name1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one
SMILESO=C1CCN(N2CCC(=O)c3ccccc32)c2ccccc21
InChIInChI=1S/C18H16N2O2/c21-17-9-11-19(15-7-3-1-5-13(15)17)20-12-10-18(22)14-6-2-4-8-16(14)20/h1-8H,9-12H2
InChIKeyMKMKMRZOTLYQHQ-UHFFFAOYSA-N
XLogP3.09
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one?
The IUPAC name of 1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one (CID 66967300) is 1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one.
What is the SMILES notation for 1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one?
The canonical SMILES for 1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one is O=C1CCN(N2CCC(=O)c3ccccc32)c2ccccc21.
What is the InChIKey of 1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one?
The InChIKey is MKMKMRZOTLYQHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H16N2O2/c21-17-9-11-19(15-7-3-1-5-13(15)17)20-12-10-18(22)14-6-2-4-8-16(14)20/h1-8H,9-12H2.
What are the key properties of 1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one?
1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one has a molecular weight of 292.34 g/mol, XLogP of 3.09, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-oxo-2,3-dihydroquinolin-1-yl)-2,3-dihydroquinolin-4-one is sourced from PubChem (CID 66967300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).