naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine

C20H14N2O2Pd — CID 139059130

IUPACnaphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine
SMILES[O-]c1cc2ccccc2cc1[O-].[Pd+2].c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.C10H8O2.Pd/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;11-9-5-7-3-1-2-4-8(7)6-10(9)12;/h1-8H;1-6,11-12H;/q;;+2/p-2
InChIKeyAMNGKHIKIIAWBA-UHFFFAOYSA-L
MW420.76 g/mol
LogP3.13
Rot. Bonds1

About naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine

naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine (PubChem CID 139059130) has the molecular formula C20H14N2O2Pd and a molecular weight of 420.76 g/mol. Its IUPAC name is naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine.

Molecular Properties

Compound Namenaphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine
PubChem CID139059130
Molecular FormulaC20H14N2O2Pd
Molecular Weight420.76 g/mol
Exact Mass420.01
IUPAC Namenaphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine
SMILES[O-]c1cc2ccccc2cc1[O-].[Pd+2].c1ccc(-c2ccccn2)nc1
InChIInChI=1S/C10H8N2.C10H8O2.Pd/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;11-9-5-7-3-1-2-4-8(7)6-10(9)12;/h1-8H;1-6,11-12H;/q;;+2/p-2
InChIKeyAMNGKHIKIIAWBA-UHFFFAOYSA-L
XLogP3.13
TPSA71.90 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.76
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

Chloroform;bis(4-methylphenolate);platinum(2+);2-pyridin-2-ylpyridine
CID 139044462
4-Tert-butyl-2-(4-tert-butyl-2-pyridinyl)pyridine;3,5-ditert-butylbenzene-1,2-diolate;nickel(2+)
CID 139047677
Naphthalene-2,3-diolate;palladium(2+);2-quinolin-2-ylquinoline
CID 139059131
(Nitrato-kappaO)[1-(pyridin-2-ylmethyliminomethyl)naphthalen-2-olato-kappaO]copper(II)
CID 139066860
Nitrato[1-(2-pyridylmethyliminomethyl)naphthalen-2-olato]zinc(II)
CID 139067441
(2,2'-Bipyridine-kappa^2^N,N'){N-[(2-oxidonaphthalen-1-yl-kappaO)methylidene]-L-valinato-kappaO}copper(II) trihydrate
CID 139083753
3,5-Ditert-butylbenzene-1,2-diolate;platinum(2+);2-pyridin-2-ylpyridine
CID 139132626
3,5-Ditert-butylbenzene-1,2-diolate;oxygen(2-);2-(pyridin-2-ylmethyliminomethyl)phenolate;vanadium;hydrate
CID 139133172
Copper;1-[3-[2-hydroxyethyl(pyridin-2-ylmethyl)amino]propyliminomethyl]naphthalen-2-olate;perchlorate
CID 139177150
Bis{mu-2-[1-(2-Pyridylmethylimino)ethyl]phenolato}bis[azidocopper(II)]
CID 168309718
dizinc;1-[[(R)-phenyl(pyridin-2-yl)methyl]iminomethyl]naphthalen-2-olate;1-[[(S)-phenyl(pyridin-2-yl)methyl]iminomethyl]naphthalen-2-olate;diazide
CID 168340850
anthracene;1-(5-phenyl-4,6-dioxa-5-boranuidatricyclo[7.4.0.03,7]trideca-1(13),2,7,9,11-pentaen-5-yl)-4-[(E)-2-[1-(5-phenyl-4,6-dioxa-5-boranuidatricyclo[7.4.0.03,7]trideca-1(13),2,7,9,11-pentaen-5-yl)pyridin-1-ium-4-yl]ethenyl]pyridin-1-ium
CID 168346079

Frequently Asked Questions

What is the IUPAC name of naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine?
The IUPAC name of naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine (CID 139059130) is naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine.
What is the SMILES notation for naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine?
The canonical SMILES for naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine is [O-]c1cc2ccccc2cc1[O-].[Pd+2].c1ccc(-c2ccccn2)nc1.
What is the InChIKey of naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine?
The InChIKey is AMNGKHIKIIAWBA-UHFFFAOYSA-L. The full InChI is InChI=1S/C10H8N2.C10H8O2.Pd/c1-3-7-11-9(5-1)10-6-2-4-8-12-10;11-9-5-7-3-1-2-4-8(7)6-10(9)12;/h1-8H;1-6,11-12H;/q;;+2/p-2.
What are the key properties of naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine?
naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine has a molecular weight of 420.76 g/mol, XLogP of 3.13, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for naphthalene-2,3-diolate;palladium(2+);2-pyridin-2-ylpyridine is sourced from PubChem (CID 139059130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).