bis(pyridine);zinc;hydrochloride

C10H11ClN2Zn — CID 67732663

IUPACbis(pyridine);zinc;hydrochloride
SMILESCl.[Zn].c1ccncc1.c1ccncc1
InChIInChI=1S/2C5H5N.ClH.Zn/c2*1-2-4-6-5-3-1;;/h2*1-5H;1H;
InChIKeyQGMQHVBBJXFPGF-UHFFFAOYSA-N
MW260.06 g/mol
LogP2.58
Rot. Bonds

About bis(pyridine);zinc;hydrochloride

bis(pyridine);zinc;hydrochloride (PubChem CID 67732663) has the molecular formula C10H11ClN2Zn and a molecular weight of 260.06 g/mol. Its IUPAC name is bis(pyridine);zinc;hydrochloride.

Molecular Properties

Compound Namebis(pyridine);zinc;hydrochloride
PubChem CID67732663
Molecular FormulaC10H11ClN2Zn
Molecular Weight260.06 g/mol
Exact Mass257.99
IUPAC Namebis(pyridine);zinc;hydrochloride
SMILESCl.[Zn].c1ccncc1.c1ccncc1
InChIInChI=1S/2C5H5N.ClH.Zn/c2*1-2-4-6-5-3-1;;/h2*1-5H;1H;
InChIKeyQGMQHVBBJXFPGF-UHFFFAOYSA-N
XLogP2.58
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.06
LogP ≤ 52.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

bis(pyridine);hydrochloride
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CID 173412563
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CID 174929298
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CID 67599995
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pyridine
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1,5-diazecine
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CID 173415684
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CID 87570870

Frequently Asked Questions

What is the IUPAC name of bis(pyridine);zinc;hydrochloride?
The IUPAC name of bis(pyridine);zinc;hydrochloride (CID 67732663) is bis(pyridine);zinc;hydrochloride.
What is the SMILES notation for bis(pyridine);zinc;hydrochloride?
The canonical SMILES for bis(pyridine);zinc;hydrochloride is Cl.[Zn].c1ccncc1.c1ccncc1.
What is the InChIKey of bis(pyridine);zinc;hydrochloride?
The InChIKey is QGMQHVBBJXFPGF-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H5N.ClH.Zn/c2*1-2-4-6-5-3-1;;/h2*1-5H;1H;.
What are the key properties of bis(pyridine);zinc;hydrochloride?
bis(pyridine);zinc;hydrochloride has a molecular weight of 260.06 g/mol, XLogP of 2.58, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for bis(pyridine);zinc;hydrochloride is sourced from PubChem (CID 67732663), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).