manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate)

C24H20MnN6O2 — CID 139161130

IUPACmanganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate)
SMILES[Mn+2].[O-]c1ccccc1/C=N/Nc1ccccn1.[O-]c1ccccc1/C=N/Nc1ccccn1
InChIInChI=1S/2C12H11N3O.Mn/c2*16-11-6-2-1-5-10(11)9-14-15-12-7-3-4-8-13-12;/h2*1-9,16H,(H,13,15);/q;;+2/p-2/b2*14-9+;
InChIKeyNFPVTUFKOBMCEW-ZNVPEIAMSA-L
MW479.40 g/mol
LogP3.20
Rot. Bonds6

About manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate)

manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate) (PubChem CID 139161130) has the molecular formula C24H20MnN6O2 and a molecular weight of 479.40 g/mol. Its IUPAC name is manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate).

Molecular Properties

Compound Namemanganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate)
PubChem CID139161130
Molecular FormulaC24H20MnN6O2
Molecular Weight479.40 g/mol
Exact Mass479.10
IUPAC Namemanganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate)
SMILES[Mn+2].[O-]c1ccccc1/C=N/Nc1ccccn1.[O-]c1ccccc1/C=N/Nc1ccccn1
InChIInChI=1S/2C12H11N3O.Mn/c2*16-11-6-2-1-5-10(11)9-14-15-12-7-3-4-8-13-12;/h2*1-9,16H,(H,13,15);/q;;+2/p-2/b2*14-9+;
InChIKeyNFPVTUFKOBMCEW-ZNVPEIAMSA-L
XLogP3.20
TPSA120.68 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500479.40
LogP ≤ 53.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

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

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Related Compounds

dicopper;4-tert-butyl-2,6-bis[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate;methanol;methanolate;diperchlorate
CID 139044017
bis(nickel(2+));bis(2-[[2-[(E)-(2-oxidophenyl)methylideneamino]-3-pyridinyl]iminomethyl]phenolate)
CID 139056067
Bis{2-[(2-pyridyl)iminomethyl]phenolato}copper(II)
CID 139077095
benzene-1,2-diolate;oxygen(2-);2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate;vanadium
CID 139139813
3,5-ditert-butylbenzene-1,2-diolate;oxygen(2-);2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate;vanadium
CID 139139814
benzene-1,2-diolate;2,4-ditert-butyl-6-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate;oxygen(2-);vanadium
CID 139139815
3,5-ditert-butylbenzene-1,2-diolate;2,4-ditert-butyl-6-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate;oxygen(2-);vanadium
CID 139139816
2-azanidylphenolate;oxygen(2-);2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate;vanadium
CID 139160031
2-azanidyl-4-tert-butylphenolate;oxygen(2-);2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate;vanadium
CID 139160032
2-azanidylphenolate;2,4-ditert-butyl-6-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate;oxygen(2-);vanadium
CID 139160033
2-azanidyl-4-tert-butylphenolate;2,4-ditert-butyl-6-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate;oxygen(2-);vanadium
CID 139160034
dicopper;bis(4-chloro-2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate);pyrazine;diperchlorate;tetrahydrate
CID 139170054

Frequently Asked Questions

What is the IUPAC name of manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate)?
The IUPAC name of manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate) (CID 139161130) is manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate).
What is the SMILES notation for manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate)?
The canonical SMILES for manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate) is [Mn+2].[O-]c1ccccc1/C=N/Nc1ccccn1.[O-]c1ccccc1/C=N/Nc1ccccn1.
What is the InChIKey of manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate)?
The InChIKey is NFPVTUFKOBMCEW-ZNVPEIAMSA-L. The full InChI is InChI=1S/2C12H11N3O.Mn/c2*16-11-6-2-1-5-10(11)9-14-15-12-7-3-4-8-13-12;/h2*1-9,16H,(H,13,15);/q;;+2/p-2/b2*14-9+;.
What are the key properties of manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate)?
manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate) has a molecular weight of 479.40 g/mol, XLogP of 3.20, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for manganese(2+);bis(2-[(E)-(pyridin-2-ylhydrazinylidene)methyl]phenolate) is sourced from PubChem (CID 139161130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).