nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol)

C26H24N4NiO2 — CID 3552662

IUPACnickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol)
SMILESOc1ccccc1/C=N/Cc1ccccn1.Oc1ccccc1C=NCc1ccccn1.[Ni]
InChIInChI=1S/2C13H12N2O.Ni/c2*16-13-7-2-1-5-11(13)9-14-10-12-6-3-4-8-15-12;/h2*1-9,16H,10H2;/b14-9+;;
InChIKeyXGUKYBFYNMOHRP-CAJRCRMVSA-N
MW483.20 g/mol
LogP4.81
Rot. Bonds6

About nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol)

nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol) (PubChem CID 3552662) has the molecular formula C26H24N4NiO2 and a molecular weight of 483.20 g/mol. Its IUPAC name is nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol).

Molecular Properties

Compound Namenickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol)
PubChem CID3552662
Molecular FormulaC26H24N4NiO2
Molecular Weight483.20 g/mol
Exact Mass482.13
IUPAC Namenickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol)
SMILESOc1ccccc1/C=N/Cc1ccccn1.Oc1ccccc1C=NCc1ccccn1.[Ni]
InChIInChI=1S/2C13H12N2O.Ni/c2*16-13-7-2-1-5-11(13)9-14-10-12-6-3-4-8-15-12;/h2*1-9,16H,10H2;/b14-9+;;
InChIKeyXGUKYBFYNMOHRP-CAJRCRMVSA-N
XLogP4.81
TPSA90.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500483.20
LogP ≤ 54.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

3-(4-Phenyl-6-pyridin-4-yl-2-pyridinyl)phenol
CID 46861757
3-(2-Phenyl-6-pyridin-4-yl-4-pyridinyl)phenol
CID 46887284
4-[6-(4-Hydroxyphenyl)-4-pyridin-3-yl-2-pyridinyl]phenol
CID 137091044
4-(2-Phenyl-6-pyridin-4-yl-4-pyridinyl)phenol
CID 136086715
2-[[3-[(2-Hydroxyphenyl)methyl-(pyridin-2-ylmethyl)amino]propyl-(pyridin-2-ylmethyl)amino]methyl]phenol
CID 44532524
3-[6-(3-Hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol
CID 122179982
2-[6-(3-Hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol
CID 137091036
4-[6-(4-Hydroxyphenyl)-4-pyridin-2-yl-2-pyridinyl]phenol
CID 137091039
2-[6-(3-Hydroxyphenyl)-4-pyridin-3-yl-2-pyridinyl]phenol
CID 137091041
2-(2-pyridin-3-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol
CID 137283314
2-(2-pyridin-4-yl-5H-indeno[1,2-b]pyridin-4-yl)phenol
CID 137317442
3-(2-Phenyl-6-pyridin-2-yl-4-pyridinyl)phenol
CID 46887245

Frequently Asked Questions

What is the IUPAC name of nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol)?
The IUPAC name of nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol) (CID 3552662) is nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol).
What is the SMILES notation for nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol)?
The canonical SMILES for nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol) is Oc1ccccc1/C=N/Cc1ccccn1.Oc1ccccc1C=NCc1ccccn1.[Ni].
What is the InChIKey of nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol)?
The InChIKey is XGUKYBFYNMOHRP-CAJRCRMVSA-N. The full InChI is InChI=1S/2C13H12N2O.Ni/c2*16-13-7-2-1-5-11(13)9-14-10-12-6-3-4-8-15-12;/h2*1-9,16H,10H2;/b14-9+;;.
What are the key properties of nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol)?
nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol) has a molecular weight of 483.20 g/mol, XLogP of 4.81, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for nickel;bis(2-(pyridin-2-ylmethyliminomethyl)phenol) is sourced from PubChem (CID 3552662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).