5H-quinolino[4,3-b]quinoxalin-6-one

C15H9N3O — CID 110273100

IUPAC5H-quinolino[4,3-b]quinoxalin-6-one
SMILESO=c1[nH]c2ccccc2c2nc3ccccc3nc12
InChIInChI=1S/C15H9N3O/c19-15-14-13(9-5-1-2-6-10(9)18-15)16-11-7-3-4-8-12(11)17-14/h1-8H,(H,18,19)
InChIKeyMPMXFOFJILXUSN-UHFFFAOYSA-N
MW247.26 g/mol
LogP2.62
Rot. Bonds

About 5H-quinolino[4,3-b]quinoxalin-6-one

5H-quinolino[4,3-b]quinoxalin-6-one (PubChem CID 110273100) has the molecular formula C15H9N3O and a molecular weight of 247.26 g/mol. Its IUPAC name is 5H-quinolino[4,3-b]quinoxalin-6-one.

Molecular Properties

Compound Name5H-quinolino[4,3-b]quinoxalin-6-one
PubChem CID110273100
Molecular FormulaC15H9N3O
Molecular Weight247.26 g/mol
Exact Mass247.07
IUPAC Name5H-quinolino[4,3-b]quinoxalin-6-one
SMILESO=c1[nH]c2ccccc2c2nc3ccccc3nc12
InChIInChI=1S/C15H9N3O/c19-15-14-13(9-5-1-2-6-10(9)18-15)16-11-7-3-4-8-12(11)17-14/h1-8H,(H,18,19)
InChIKeyMPMXFOFJILXUSN-UHFFFAOYSA-N
XLogP2.62
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}, {'alert_name': 'Polycyclic_aromatic_hydrocarbon_3', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5H-quinolino[4,3-b]quinoxalin-6-one?
The IUPAC name of 5H-quinolino[4,3-b]quinoxalin-6-one (CID 110273100) is 5H-quinolino[4,3-b]quinoxalin-6-one.
What is the SMILES notation for 5H-quinolino[4,3-b]quinoxalin-6-one?
The canonical SMILES for 5H-quinolino[4,3-b]quinoxalin-6-one is O=c1[nH]c2ccccc2c2nc3ccccc3nc12.
What is the InChIKey of 5H-quinolino[4,3-b]quinoxalin-6-one?
The InChIKey is MPMXFOFJILXUSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H9N3O/c19-15-14-13(9-5-1-2-6-10(9)18-15)16-11-7-3-4-8-12(11)17-14/h1-8H,(H,18,19).
What are the key properties of 5H-quinolino[4,3-b]quinoxalin-6-one?
5H-quinolino[4,3-b]quinoxalin-6-one has a molecular weight of 247.26 g/mol, XLogP of 2.62, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5H-quinolino[4,3-b]quinoxalin-6-one is sourced from PubChem (CID 110273100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).