zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide)

C24H20N6Zn — CID 139168715

IUPACzinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide)
SMILESC(=N\[N-]c1ccccc1)\c1ccccn1.C(=N\[N-]c1ccccc1)\c1ccccn1.[Zn+2]
InChIInChI=1S/2C12H10N3.Zn/c2*1-2-6-11(7-3-1)15-14-10-12-8-4-5-9-13-12;/h2*1-10H;/q2*-1;+2/b2*14-10-;
InChIKeyISKDDJNMUCWIQZ-YKXCFZHZSA-N
MW457.86 g/mol
LogP6.24
Rot. Bonds6

About zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide)

zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide) (PubChem CID 139168715) has the molecular formula C24H20N6Zn and a molecular weight of 457.86 g/mol. Its IUPAC name is zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide).

Molecular Properties

Compound Namezinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide)
PubChem CID139168715
Molecular FormulaC24H20N6Zn
Molecular Weight457.86 g/mol
Exact Mass456.10
IUPAC Namezinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide)
SMILESC(=N\[N-]c1ccccc1)\c1ccccn1.C(=N\[N-]c1ccccc1)\c1ccccn1.[Zn+2]
InChIInChI=1S/2C12H10N3.Zn/c2*1-2-6-11(7-3-1)15-14-10-12-8-4-5-9-13-12;/h2*1-10H;/q2*-1;+2/b2*14-10-;
InChIKeyISKDDJNMUCWIQZ-YKXCFZHZSA-N
XLogP6.24
TPSA78.70 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500457.86
LogP ≤ 56.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

manganese(2+);pyridin-2-yl-(pyridin-2-ylmethylideneamino)azanide
CID 3585581
2-(2-pyridin-2-ylethenyl)pyridine
CID 161029843
N-tert-butyl-1-pyridin-2-ylmethanimine
CID 11389570
N-phenoxy-1-pyridin-2-ylmethanimine
CID 54492053
N-(2-phenylethyl)-1-pyridin-2-ylmethanimine
CID 15790389
CID 59444659
CID 59444659
N-propyl-1-pyridin-2-ylmethanimine
CID 11205848
bis([benzylsulfanyl(sulfoniumylidene)methyl]-(pyridin-2-ylmethylideneamino)azanide);copper
CID 3344493
copper [(benzylamino)-sulfoniumylidenemethyl]-(pyridin-2-ylmethylideneamino)azanide
CID 135401859
N-[(2-methylpropan-2-yl)oxy]-1-pyridin-2-ylmethanimine
CID 141131461
N'-[(E)-pyridin-2-ylmethylideneamino]carbamimidoselenoate
CID 54577616
2-N-[(E)-pyridin-2-ylmethylideneamino]-3-N-[(Z)-[(3Z)-3-[(Z)-[(3E)-3-[(E)-pyridin-2-ylmethylidenehydrazinylidene]butan-2-ylidene]hydrazinylidene]butan-2-ylidene]amino]butane-2,3-diimine
CID 11979937

Frequently Asked Questions

What is the IUPAC name of zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide)?
The IUPAC name of zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide) (CID 139168715) is zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide).
What is the SMILES notation for zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide)?
The canonical SMILES for zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide) is C(=N\[N-]c1ccccc1)\c1ccccn1.C(=N\[N-]c1ccccc1)\c1ccccn1.[Zn+2].
What is the InChIKey of zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide)?
The InChIKey is ISKDDJNMUCWIQZ-YKXCFZHZSA-N. The full InChI is InChI=1S/2C12H10N3.Zn/c2*1-2-6-11(7-3-1)15-14-10-12-8-4-5-9-13-12;/h2*1-10H;/q2*-1;+2/b2*14-10-;.
What are the key properties of zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide)?
zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide) has a molecular weight of 457.86 g/mol, XLogP of 6.24, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for zinc bis(phenyl-[(Z)-pyridin-2-ylmethylideneamino]azanide) is sourced from PubChem (CID 139168715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).