zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine)

C20H16N6Zn — CID 139164562

IUPACzinc bis(N-pyridin-2-ylpyridin-1-id-2-imine)
SMILES[Zn+2].c1ccc(N=c2cccc[n-]2)nc1.c1ccc(N=c2cccc[n-]2)nc1
InChIInChI=1S/2C10H8N3.Zn/c2*1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;/h2*1-8H;/q2*-1;+2
InChIKeyHNUPDZPQGYCOCO-UHFFFAOYSA-N
MW405.78 g/mol
LogP2.54
Rot. Bonds2

About zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine)

zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine) (PubChem CID 139164562) has the molecular formula C20H16N6Zn and a molecular weight of 405.78 g/mol. Its IUPAC name is zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine).

Molecular Properties

Compound Namezinc bis(N-pyridin-2-ylpyridin-1-id-2-imine)
PubChem CID139164562
Molecular FormulaC20H16N6Zn
Molecular Weight405.78 g/mol
Exact Mass404.07
IUPAC Namezinc bis(N-pyridin-2-ylpyridin-1-id-2-imine)
SMILES[Zn+2].c1ccc(N=c2cccc[n-]2)nc1.c1ccc(N=c2cccc[n-]2)nc1
InChIInChI=1S/2C10H8N3.Zn/c2*1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;/h2*1-8H;/q2*-1;+2
InChIKeyHNUPDZPQGYCOCO-UHFFFAOYSA-N
XLogP2.54
TPSA78.70 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500405.78
LogP ≤ 52.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

2,2'-Dipyridylamine
CID 14547
2-Dimethylaminopyridine
CID 21885
N,N'-Di-2-pyridinylthiourea
CID 702572
1,6-Bis(4-(pyridin-2-yl)piperazin-1-yl)hexane
CID 11524350
1-(3-Fluoropyridin-2-yl)-4-methylpiperazine
CID 13298530
11-Ethyldipyrido[2,3-b:3',2'-f]azepine
CID 470619
1-Methyl-4-(pyridin-2-yl)piperazine
CID 14954817
PD-135222
CID 15079632
Ambcb5479914
CID 9585941
1-Phenyl-4-(6-(4-(pyridin-2-yl)piperazin-1-yl)hexyl)piperazine
CID 11704191
2-(Phenylazo)pyridine
CID 4313470
1-Pyridin-2-yl-4-(4-pyridin-3-yl-but-3-ynyl)-piperazine
CID 10637409

Frequently Asked Questions

What is the IUPAC name of zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine)?
The IUPAC name of zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine) (CID 139164562) is zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine).
What is the SMILES notation for zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine)?
The canonical SMILES for zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine) is [Zn+2].c1ccc(N=c2cccc[n-]2)nc1.c1ccc(N=c2cccc[n-]2)nc1.
What is the InChIKey of zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine)?
The InChIKey is HNUPDZPQGYCOCO-UHFFFAOYSA-N. The full InChI is InChI=1S/2C10H8N3.Zn/c2*1-3-7-11-9(5-1)13-10-6-2-4-8-12-10;/h2*1-8H;/q2*-1;+2.
What are the key properties of zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine)?
zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine) has a molecular weight of 405.78 g/mol, XLogP of 2.54, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for zinc bis(N-pyridin-2-ylpyridin-1-id-2-imine) is sourced from PubChem (CID 139164562), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).