iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium

C18H10IrNOY-3 — CID 153447045

IUPACiridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium
SMILES[Ir].[Y].[c-]1ccccc1-c1[c-]nc2c(c1)OCc1ccc[c-]c1-2
InChIInChI=1S/C18H10NO.Ir.Y/c1-2-6-13(7-3-1)15-10-17-18(19-11-15)16-9-5-4-8-14(16)12-20-17;;/h1-6,8,10H,12H2;;/q-3;;
InChIKeyUTWPVHIIWRMOGV-UHFFFAOYSA-N
MW537.41 g/mol
LogP3.70
Rot. Bonds1

About iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium

iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium (PubChem CID 153447045) has the molecular formula C18H10IrNOY-3 and a molecular weight of 537.41 g/mol. Its IUPAC name is iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium.

Molecular Properties

Compound Nameiridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium
PubChem CID153447045
Molecular FormulaC18H10IrNOY-3
Molecular Weight537.41 g/mol
Exact Mass537.95
IUPAC Nameiridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium
SMILES[Ir].[Y].[c-]1ccccc1-c1[c-]nc2c(c1)OCc1ccc[c-]c1-2
InChIInChI=1S/C18H10NO.Ir.Y/c1-2-6-13(7-3-1)15-10-17-18(19-11-15)16-9-5-4-8-14(16)12-20-17;;/h1-6,8,10H,12H2;;/q-3;;
InChIKeyUTWPVHIIWRMOGV-UHFFFAOYSA-N
XLogP3.70
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500537.41
LogP ≤ 53.70
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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Related Compounds

6,10-dihydroisochromeno[4,3-b]pyridin-10-ide;iridium;1-phenylisoquinoline
CID 153446953
6,10-dihydroisochromeno[4,3-c]isoquinolin-10-ide;iridium;2-phenylpyridine
CID 153447014
(Z)-4-hydroxypent-3-en-2-one;iridium;3-phenyl-6,10-dihydro-4H-isochromeno[4,3-b]pyridine-4,10-diide;yttrium
CID 153446994
iridium;8-(2-methylpropyl)-1,5-dihydroisochromeno[4,3-b]quinolin-1-ide;1-phenylisoquinoline
CID 153446971
iridium;8-phenyl-7,10-dihydro-6H-isochromeno[4,3-b]pyridine-7,10-diide;yttrium
CID 153447007
iridium;phenylbenzene
CID 58599975
iridium;4-phenyl-6,10-dihydro-3H-isochromeno[4,3-b]pyridine-3,10-diide;2-pyridin-2-ylindol-1-ide;yttrium
CID 153447085
ethane;phenylbenzene;yttrium
CID 161119758
iridium;4-phenyl-3,5-dihydro-1H-isochromeno[4,3-b]quinoline-1,3-diide;3-phenylisoquinoline;yttrium
CID 153447088
1,3-di(phenyl)benzene-4,6-diide;tetrakis(yttrium)
CID 160503199
lithium 2-phenyl-4,5-dihydro-1,3-oxazole
CID 25258689
1-phenyl-4-[4-[4-(4-phenylbenzene-3,6-diid-1-yl)benzene-3,6-diid-1-yl]benzene-3,6-diid-1-yl]benzene-3,6-diide;pentakis(yttrium)
CID 153293138

Frequently Asked Questions

What is the IUPAC name of iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium?
The IUPAC name of iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium (CID 153447045) is iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium.
What is the SMILES notation for iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium?
The canonical SMILES for iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium is [Ir].[Y].[c-]1ccccc1-c1[c-]nc2c(c1)OCc1ccc[c-]c1-2.
What is the InChIKey of iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium?
The InChIKey is UTWPVHIIWRMOGV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H10NO.Ir.Y/c1-2-6-13(7-3-1)15-10-17-18(19-11-15)16-9-5-4-8-14(16)12-20-17;;/h1-6,8,10H,12H2;;/q-3;;.
What are the key properties of iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium?
iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium has a molecular weight of 537.41 g/mol, XLogP of 3.70, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for iridium;3-phenyl-6,10-dihydro-2H-isochromeno[4,3-b]pyridine-2,10-diide;yttrium is sourced from PubChem (CID 153447045), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).