2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol

C19H16N2O3Pt — CID 10186083

IUPAC2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol
SMILESOCc1ccncc1.[O-]c1ccccc1/C=N/c1ccccc1[O-].[Pt+2]
InChIInChI=1S/C13H11NO2.C6H7NO.Pt/c15-12-7-3-1-5-10(12)9-14-11-6-2-4-8-13(11)16;8-5-6-1-3-7-4-2-6;/h1-9,15-16H;1-4,8H,5H2;/q;;+2/p-2/b14-9+;;
InChIKeyLDPJYXPSIYWECN-CAJRCRMVSA-L
MW515.43 g/mol
LogP2.16
Rot. Bonds3

About 2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol

2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol (PubChem CID 10186083) has the molecular formula C19H16N2O3Pt and a molecular weight of 515.43 g/mol. Its IUPAC name is 2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol.

Molecular Properties

Compound Name2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol
PubChem CID10186083
Molecular FormulaC19H16N2O3Pt
Molecular Weight515.43 g/mol
Exact Mass515.08
IUPAC Name2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol
SMILESOCc1ccncc1.[O-]c1ccccc1/C=N/c1ccccc1[O-].[Pt+2]
InChIInChI=1S/C13H11NO2.C6H7NO.Pt/c15-12-7-3-1-5-10(12)9-14-11-6-2-4-8-13(11)16;8-5-6-1-3-7-4-2-6;/h1-9,15-16H;1-4,8H,5H2;/q;;+2/p-2/b14-9+;;
InChIKeyLDPJYXPSIYWECN-CAJRCRMVSA-L
XLogP2.16
TPSA91.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500515.43
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

nickel;2-[[2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate
CID 58725494
zinc;methanol;2-[[2-[2-[2-[(2-oxidophenyl)iminomethyl]phenoxy]ethoxy]phenyl]methylideneamino]phenolate
CID 139175016
CID 174107142
CID 174107142
tetrakis(2,6-dimethylphenolate);bis(2-[[2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate);bis(titanium(4+))
CID 139136922
methanol;tetrakis(4-methyl-2-[(2-oxidophenyl)methylideneamino]phenolate);tetrakis(nickel(2+))
CID 139177480
bis(2-[[1,3-dihydroxy-2-(hydroxymethyl)propan-2-yl]iminomethyl]phenolate);nickel(2+);pyridine
CID 139070495
bis(4-chloropyridine);cobalt(3+);methanol;2-[2-[(2-oxidophenyl)methylideneamino]ethyliminomethyl]phenolate;perchlorate
CID 139080116
2-[2-(2-oxidophenyl)iminoethylideneamino]phenolate
CID 101383278
2-[[4,5-dimethoxy-2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate
CID 101450590
hexakis(iron(3+));hexakis(2-[[2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate);5-[3,6,7,10,11-pentakis(4-carboxylatobutoxy)triphenylen-2-yl]oxypentanoate
CID 54597793
dicopper;bis(1-[(2-oxidophenyl)iminomethyl]naphthalen-2-olate);bis(pyridine)
CID 139078158
ethanol;2-[[4-nitro-2-[(2-oxidophenyl)methylideneamino]phenyl]iminomethyl]phenolate;bis(oxygen(2-));uranium
CID 139170496

Frequently Asked Questions

What is the IUPAC name of 2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol?
The IUPAC name of 2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol (CID 10186083) is 2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol.
What is the SMILES notation for 2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol?
The canonical SMILES for 2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol is OCc1ccncc1.[O-]c1ccccc1/C=N/c1ccccc1[O-].[Pt+2].
What is the InChIKey of 2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol?
The InChIKey is LDPJYXPSIYWECN-CAJRCRMVSA-L. The full InChI is InChI=1S/C13H11NO2.C6H7NO.Pt/c15-12-7-3-1-5-10(12)9-14-11-6-2-4-8-13(11)16;8-5-6-1-3-7-4-2-6;/h1-9,15-16H;1-4,8H,5H2;/q;;+2/p-2/b14-9+;;.
What are the key properties of 2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol?
2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol has a molecular weight of 515.43 g/mol, XLogP of 2.16, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-oxidophenyl)iminomethyl]phenolate;platinum(2+);pyridin-4-ylmethanol is sourced from PubChem (CID 10186083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).