iridium;2-phenylimidazo[1,2-a]pyridine

C13H9IrN2- — CID 58761392

IUPACiridium;2-phenylimidazo[1,2-a]pyridine
SMILES[Ir].[c-]1ccccc1-c1cn2ccccc2n1
InChIInChI=1S/C13H9N2.Ir/c1-2-6-11(7-3-1)12-10-15-9-5-4-8-13(15)14-12;/h1-6,8-10H;/q-1;
InChIKeyZPYJOCBJCVAQRB-UHFFFAOYSA-N
MW385.45 g/mol
LogP2.80
Rot. Bonds1

About iridium;2-phenylimidazo[1,2-a]pyridine

iridium;2-phenylimidazo[1,2-a]pyridine (PubChem CID 58761392) has the molecular formula C13H9IrN2- and a molecular weight of 385.45 g/mol. Its IUPAC name is iridium;2-phenylimidazo[1,2-a]pyridine.

Molecular Properties

Compound Nameiridium;2-phenylimidazo[1,2-a]pyridine
PubChem CID58761392
Molecular FormulaC13H9IrN2-
Molecular Weight385.45 g/mol
Exact Mass386.04
IUPAC Nameiridium;2-phenylimidazo[1,2-a]pyridine
SMILES[Ir].[c-]1ccccc1-c1cn2ccccc2n1
InChIInChI=1S/C13H9N2.Ir/c1-2-6-11(7-3-1)12-10-15-9-5-4-8-13(15)14-12;/h1-6,8-10H;/q-1;
InChIKeyZPYJOCBJCVAQRB-UHFFFAOYSA-N
XLogP2.80
TPSA17.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.45
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of iridium;2-phenylimidazo[1,2-a]pyridine?
The IUPAC name of iridium;2-phenylimidazo[1,2-a]pyridine (CID 58761392) is iridium;2-phenylimidazo[1,2-a]pyridine.
What is the SMILES notation for iridium;2-phenylimidazo[1,2-a]pyridine?
The canonical SMILES for iridium;2-phenylimidazo[1,2-a]pyridine is [Ir].[c-]1ccccc1-c1cn2ccccc2n1.
What is the InChIKey of iridium;2-phenylimidazo[1,2-a]pyridine?
The InChIKey is ZPYJOCBJCVAQRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N2.Ir/c1-2-6-11(7-3-1)12-10-15-9-5-4-8-13(15)14-12;/h1-6,8-10H;/q-1;.
What are the key properties of iridium;2-phenylimidazo[1,2-a]pyridine?
iridium;2-phenylimidazo[1,2-a]pyridine has a molecular weight of 385.45 g/mol, XLogP of 2.80, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for iridium;2-phenylimidazo[1,2-a]pyridine is sourced from PubChem (CID 58761392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).