ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine

C46H33N4O7Pd2- — CID 159087570

IUPACethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine
SMILESC[C-]=O.[Pd+2].[Pd].[c-]1c(Oc2[c-]c(Oc3ccccn3)ccc2)cccc1Oc1ccccn1.c1ccc(Oc2cccc(Oc3cccc(Oc4ccccn4)c3)c2)nc1
InChIInChI=1S/C22H16N2O3.C22H14N2O3.C2H3O.2Pd/c2*1-3-13-23-21(11-1)26-19-9-5-7-17(15-19)25-18-8-6-10-20(16-18)27-22-12-2-4-14-24-22;1-2-3;;/h1-16H;1-14H;1H3;;/q;-2;-1;;+2
InChIKeyLVLWGNOJLCQWCD-UHFFFAOYSA-N
MW966.63 g/mol
LogP11.42
Rot. Bonds12

About ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine

ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine (PubChem CID 159087570) has the molecular formula C46H33N4O7Pd2- and a molecular weight of 966.63 g/mol. Its IUPAC name is ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine.

Molecular Properties

Compound Nameethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine
PubChem CID159087570
Molecular FormulaC46H33N4O7Pd2-
Molecular Weight966.63 g/mol
Exact Mass965.04
IUPAC Nameethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine
SMILESC[C-]=O.[Pd+2].[Pd].[c-]1c(Oc2[c-]c(Oc3ccccn3)ccc2)cccc1Oc1ccccn1.c1ccc(Oc2cccc(Oc3cccc(Oc4ccccn4)c3)c2)nc1
InChIInChI=1S/C22H16N2O3.C22H14N2O3.C2H3O.2Pd/c2*1-3-13-23-21(11-1)26-19-9-5-7-17(15-19)25-18-8-6-10-20(16-18)27-22-12-2-4-14-24-22;1-2-3;;/h1-16H;1-14H;1H3;;/q;-2;-1;;+2
InChIKeyLVLWGNOJLCQWCD-UHFFFAOYSA-N
XLogP11.42
TPSA124.01 Ų
H-Bond Donors
H-Bond Acceptors11
Rotatable Bonds12
Heavy Atoms59
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500966.63
LogP ≤ 511.42
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1011

Computed Properties (RDKit)

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

Analyze ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine with MolForge

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Related Compounds

iridium(3+);2-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxy-6-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine
CID 140597838
2-[3-(3-pyridin-2-yloxyphenoxy)phenyl]pyridine
CID 67464516
platinum(2+);6-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxypyridine-2-carbothioate
CID 58709124
ethane;2-phenoxypyridine
CID 90835857
2-[3-[3-[3-(3-pyridin-2-yloxyphenoxy)prop-2-ynoxy]prop-1-ynoxy]phenoxy]pyridine
CID 54314681
1-[6-(3-pyridin-2-yloxyphenoxy)-2-pyridinyl]propane-1,2-dione
CID 67475111
2-methyl-6-[3-[(6-methyl-2-pyridinyl)oxy]-5-pyridin-2-yloxyphenoxy]pyridine
CID 146608885
3-pyridin-2-yloxybenzenesulfonyl chloride
CID 166604318
2-[3-(methoxymethyl)phenoxy]pyridine
CID 174239052
3-[3-(3-pyridin-2-yloxyphenoxy)phenyl]isoquinoline
CID 159467919
N-(3-pyridin-2-yloxyphenyl)formamide
CID 91518983
CID 157216232
CID 157216232

Frequently Asked Questions

What is the IUPAC name of ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine?
The IUPAC name of ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine (CID 159087570) is ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine.
What is the SMILES notation for ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine?
The canonical SMILES for ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine is C[C-]=O.[Pd+2].[Pd].[c-]1c(Oc2[c-]c(Oc3ccccn3)ccc2)cccc1Oc1ccccn1.c1ccc(Oc2cccc(Oc3cccc(Oc4ccccn4)c3)c2)nc1.
What is the InChIKey of ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine?
The InChIKey is LVLWGNOJLCQWCD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H16N2O3.C22H14N2O3.C2H3O.2Pd/c2*1-3-13-23-21(11-1)26-19-9-5-7-17(15-19)25-18-8-6-10-20(16-18)27-22-12-2-4-14-24-22;1-2-3;;/h1-16H;1-14H;1H3;;/q;-2;-1;;+2.
What are the key properties of ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine?
ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine has a molecular weight of 966.63 g/mol, XLogP of 11.42, 12 rotatable bonds, 0 hydrogen bond donors, and 11 hydrogen bond acceptors.
Where does this data come from?
All data for ethanone;palladium;palladium(2+);2-[3-(3-pyridin-2-yloxybenzene-2-id-1-yl)oxybenzene-2-id-1-yl]oxypyridine;2-[3-(3-pyridin-2-yloxyphenoxy)phenoxy]pyridine is sourced from PubChem (CID 159087570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).