2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium

C10H5F2IrN2- — CID 177432309

IUPAC2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium
SMILESFc1c[c-]c(-c2ccccn2)c(F)n1.[Ir]
InChIInChI=1S/C10H5F2N2.Ir/c11-9-5-4-7(10(12)14-9)8-3-1-2-6-13-8;/h1-3,5-6H;/q-1;
InChIKeyPMEAXCZZCZNFBZ-UHFFFAOYSA-N
MW383.38 g/mol
LogP2.22
Rot. Bonds1

About 2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium

2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium (PubChem CID 177432309) has the molecular formula C10H5F2IrN2- and a molecular weight of 383.38 g/mol. Its IUPAC name is 2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium.

Molecular Properties

Compound Name2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium
PubChem CID177432309
Molecular FormulaC10H5F2IrN2-
Molecular Weight383.38 g/mol
Exact Mass384.01
IUPAC Name2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium
SMILESFc1c[c-]c(-c2ccccn2)c(F)n1.[Ir]
InChIInChI=1S/C10H5F2N2.Ir/c11-9-5-4-7(10(12)14-9)8-3-1-2-6-13-8;/h1-3,5-6H;/q-1;
InChIKeyPMEAXCZZCZNFBZ-UHFFFAOYSA-N
XLogP2.22
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.38
LogP ≤ 52.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}

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Related Compounds

2,6-difluoro-3-(4-methyl-2-pyridinyl)-4H-pyridin-4-ide;2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;bis(iridium)
CID 159075536
2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium(3+);propan-2-yl-[propan-2-ylazanidyl(1,2,4-triazol-1-yl)methyl]azanide
CID 153420867
2-(2-fluorobenzene-6-id-1-yl)pyridine;iridium
CID 21044153
4-(2,2-dimethylpropyl)-2-[4-(2,2-dimethylpropyl)-2-pyridinyl]pyridine;3-[4-(2,2-dimethylpropyl)-2-pyridinyl]-2,6-difluoro-4H-pyridin-4-ide;iridium
CID 58162269
carbanide;2-(2,4-difluorobenzene-6-id-1-yl)pyridine;platinum
CID 21044191
2-(2,4-difluoro-3-isocyanobenzene-6-id-1-yl)pyridine;iridium
CID 58880833
2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;3-(2,6-diphenylphenyl)-6,7-dimethyl-12H-imidazo[1,2-f]phenanthridin-12-ide;iridium
CID 58162931
bis(2-(2,4-difluorobenzene-6-id-1-yl)pyridine);iridium;5-pyridin-2-yl-1,2,4-triazine
CID 155643108
iridium;2-(4-phenyl-2H-naphthalen-2-id-1-yl)pyridine
CID 153288374
2-(2,4-difluorobenzene-6-id-1-yl)pyridine;2-(5-fluoroimidazol-3-id-4-yl)pyridine;iridium
CID 20807217
2-[4-ethenyl-2,3-bis(2-pyridin-2-ylphenyl)benzene-6-id-1-yl]pyridine;iridium
CID 87088563
iridium;2-pyridin-2-ylpyridine;ruthenium
CID 174707743

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium?
The IUPAC name of 2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium (CID 177432309) is 2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium.
What is the SMILES notation for 2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium?
The canonical SMILES for 2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium is Fc1c[c-]c(-c2ccccn2)c(F)n1.[Ir].
What is the InChIKey of 2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium?
The InChIKey is PMEAXCZZCZNFBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H5F2N2.Ir/c11-9-5-4-7(10(12)14-9)8-3-1-2-6-13-8;/h1-3,5-6H;/q-1;.
What are the key properties of 2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium?
2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium has a molecular weight of 383.38 g/mol, XLogP of 2.22, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-3-pyridin-2-yl-4H-pyridin-4-ide;iridium is sourced from PubChem (CID 177432309), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).