9-fluorocinnolino[4,3-b]quinoxaline

C14H7FN4 — CID 10264104

IUPAC9-fluorocinnolino[4,3-b]quinoxaline
SMILESFc1ccc2nc3c(nnc4ccccc43)nc2c1
InChIInChI=1S/C14H7FN4/c15-8-5-6-11-12(7-8)17-14-13(16-11)9-3-1-2-4-10(9)18-19-14/h1-7H
InChIKeyMQKAQCILYZXYLI-UHFFFAOYSA-N
MW250.24 g/mol
LogP2.87
Rot. Bonds

About 9-fluorocinnolino[4,3-b]quinoxaline

9-fluorocinnolino[4,3-b]quinoxaline (PubChem CID 10264104) has the molecular formula C14H7FN4 and a molecular weight of 250.24 g/mol. Its IUPAC name is 9-fluorocinnolino[4,3-b]quinoxaline.

Molecular Properties

Compound Name9-fluorocinnolino[4,3-b]quinoxaline
PubChem CID10264104
Molecular FormulaC14H7FN4
Molecular Weight250.24 g/mol
Exact Mass250.07
IUPAC Name9-fluorocinnolino[4,3-b]quinoxaline
SMILESFc1ccc2nc3c(nnc4ccccc43)nc2c1
InChIInChI=1S/C14H7FN4/c15-8-5-6-11-12(7-8)17-14-13(16-11)9-3-1-2-4-10(9)18-19-14/h1-7H
InChIKeyMQKAQCILYZXYLI-UHFFFAOYSA-N
XLogP2.87
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.24
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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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Related Compounds

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CID 213010
5-Methylbenzimidazolo[2,1-a]phthalazine
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CID 285054
1-Ethyl-3-phenylpyrazolo[4,3-b]quinoxaline
CID 665240
1-methyl-3-phenyl-1H-pyrazolo[3,4-b]quinoxaline
CID 664134
Quinoxalino[2,3-c]cinnoline
CID 1486802
5-Butyl-2-(4-fluoro-phenyl)-[1,2,4]triazolo[1,5-c]quinazoline
CID 17863215
3-Phenyl-benzo(1,2,4)triazine
CID 239695
2-(2H-benzo[d][1,2,3]triazol-2-yl)-4-phenylquinazoline
CID 950700
5-Chloro-3-(3-fluorophenyl)triazolo[1,5-a]quinazoline
CID 2137463
3-(4-Fluorophenyl)-5-hydrazino[1,2,3]triazolo[1,5-a]quinazoline
CID 16195388
6-[2-(4-Fluorophenyl)ethyl]pyrido[3,2-d]pyrimidine-2,4-diamine
CID 137654559

Frequently Asked Questions

What is the IUPAC name of 9-fluorocinnolino[4,3-b]quinoxaline?
The IUPAC name of 9-fluorocinnolino[4,3-b]quinoxaline (CID 10264104) is 9-fluorocinnolino[4,3-b]quinoxaline.
What is the SMILES notation for 9-fluorocinnolino[4,3-b]quinoxaline?
The canonical SMILES for 9-fluorocinnolino[4,3-b]quinoxaline is Fc1ccc2nc3c(nnc4ccccc43)nc2c1.
What is the InChIKey of 9-fluorocinnolino[4,3-b]quinoxaline?
The InChIKey is MQKAQCILYZXYLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H7FN4/c15-8-5-6-11-12(7-8)17-14-13(16-11)9-3-1-2-4-10(9)18-19-14/h1-7H.
What are the key properties of 9-fluorocinnolino[4,3-b]quinoxaline?
9-fluorocinnolino[4,3-b]quinoxaline has a molecular weight of 250.24 g/mol, XLogP of 2.87, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 9-fluorocinnolino[4,3-b]quinoxaline is sourced from PubChem (CID 10264104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).