5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline

C18H10F2N2 — CID 158692167

IUPAC5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline
SMILESFc1cc2cc(F)c3cccnc3c2cc1-c1ccccn1
InChIInChI=1S/C18H10F2N2/c19-15-8-11-9-16(20)14(17-5-1-2-6-21-17)10-13(11)18-12(15)4-3-7-22-18/h1-10H
InChIKeyINTFDDRROLNNCE-UHFFFAOYSA-N
MW292.29 g/mol
LogP4.73
Rot. Bonds1

About 5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline

5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline (PubChem CID 158692167) has the molecular formula C18H10F2N2 and a molecular weight of 292.29 g/mol. Its IUPAC name is 5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline.

Molecular Properties

Compound Name5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline
PubChem CID158692167
Molecular FormulaC18H10F2N2
Molecular Weight292.29 g/mol
Exact Mass292.08
IUPAC Name5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline
SMILESFc1cc2cc(F)c3cccnc3c2cc1-c1ccccn1
InChIInChI=1S/C18H10F2N2/c19-15-8-11-9-16(20)14(17-5-1-2-6-21-17)10-13(11)18-12(15)4-3-7-22-18/h1-10H
InChIKeyINTFDDRROLNNCE-UHFFFAOYSA-N
XLogP4.73
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.29
LogP ≤ 54.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(2,5-difluoro-4-methylphenyl)pyridine
CID 170974832
2-(4-chloro-2-fluorophenyl)pyridine
CID 57200729
4-chloro-7-fluoro-3-methyl-2,6-dipyridin-2-ylquinoline
CID 59631148
8-pyridin-2-ylquinoline
CID 10982041
4,8-dipyridin-2-yl-1,5-naphthyridine
CID 141460445
5,8-dipyridin-2-ylquinoxaline
CID 102128450
6,12-di(phenanthren-9-yl)quinolino[8,7-h]quinoline
CID 88544757
bis(2-pyridin-2-ylpyridine);quinoxalino[2,3-f][1,10]phenanthroline;ruthenium
CID 76514831
2-(5-chloro-2,4-difluorophenyl)-3-pyridin-2-ylpyridine
CID 90095092
2-(2,4-difluorophenyl)pyridine;trichloroiridium
CID 174879451
8-chloro-5-fluoroquinoline
CID 53435993
2-(2-tert-butylphenyl)pyridine
CID 67807360

Frequently Asked Questions

What is the IUPAC name of 5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline?
The IUPAC name of 5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline (CID 158692167) is 5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline.
What is the SMILES notation for 5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline?
The canonical SMILES for 5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline is Fc1cc2cc(F)c3cccnc3c2cc1-c1ccccn1.
What is the InChIKey of 5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline?
The InChIKey is INTFDDRROLNNCE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10F2N2/c19-15-8-11-9-16(20)14(17-5-1-2-6-21-17)10-13(11)18-12(15)4-3-7-22-18/h1-10H.
What are the key properties of 5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline?
5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline has a molecular weight of 292.29 g/mol, XLogP of 4.73, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,8-difluoro-9-pyridin-2-ylbenzo[h]quinoline is sourced from PubChem (CID 158692167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).