2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione

C16H9FN2O2 — CID 58939138

IUPAC2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione
SMILESO=c1c2ccccc2[nH]c2c(=O)c3cc(F)ccc3[nH]c12
InChIInChI=1S/C16H9FN2O2/c17-8-5-6-12-10(7-8)16(21)14-13(19-12)15(20)9-3-1-2-4-11(9)18-14/h1-7H,(H,18,20)(H,19,21)
InChIKeyNWWYVWIGLKHIPW-UHFFFAOYSA-N
MW280.26 g/mol
LogP2.66
Rot. Bonds

About 2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione

2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione (PubChem CID 58939138) has the molecular formula C16H9FN2O2 and a molecular weight of 280.26 g/mol. Its IUPAC name is 2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione.

Molecular Properties

Compound Name2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione
PubChem CID58939138
Molecular FormulaC16H9FN2O2
Molecular Weight280.26 g/mol
Exact Mass280.06
IUPAC Name2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione
SMILESO=c1c2ccccc2[nH]c2c(=O)c3cc(F)ccc3[nH]c12
InChIInChI=1S/C16H9FN2O2/c17-8-5-6-12-10(7-8)16(21)14-13(19-12)15(20)9-3-1-2-4-11(9)18-14/h1-7H,(H,18,20)(H,19,21)
InChIKeyNWWYVWIGLKHIPW-UHFFFAOYSA-N
XLogP2.66
TPSA65.72 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.26
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione?
The IUPAC name of 2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione (CID 58939138) is 2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione.
What is the SMILES notation for 2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione?
The canonical SMILES for 2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione is O=c1c2ccccc2[nH]c2c(=O)c3cc(F)ccc3[nH]c12.
What is the InChIKey of 2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione?
The InChIKey is NWWYVWIGLKHIPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H9FN2O2/c17-8-5-6-12-10(7-8)16(21)14-13(19-12)15(20)9-3-1-2-4-11(9)18-14/h1-7H,(H,18,20)(H,19,21).
What are the key properties of 2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione?
2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione has a molecular weight of 280.26 g/mol, XLogP of 2.66, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5,11-dihydroquinolino[3,2-b]quinoline-6,12-dione is sourced from PubChem (CID 58939138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).