copper bis(2H-pyridin-2-ide)

C10H8CuN2 — CID 19889065

IUPACcopper bis(2H-pyridin-2-ide)
SMILES[Cu+2].[c-]1ccccn1.[c-]1ccccn1
InChIInChI=1S/2C5H4N.Cu/c2*1-2-4-6-5-3-1;/h2*1-4H;/q2*-1;+2
InChIKeyXBFMLUIFTOQCAY-UHFFFAOYSA-N
MW219.73 g/mol
LogP1.76
Rot. Bonds

About copper bis(2H-pyridin-2-ide)

copper bis(2H-pyridin-2-ide) (PubChem CID 19889065) has the molecular formula C10H8CuN2 and a molecular weight of 219.73 g/mol. Its IUPAC name is copper bis(2H-pyridin-2-ide).

Molecular Properties

Compound Namecopper bis(2H-pyridin-2-ide)
PubChem CID19889065
Molecular FormulaC10H8CuN2
Molecular Weight219.73 g/mol
Exact Mass219.00
IUPAC Namecopper bis(2H-pyridin-2-ide)
SMILES[Cu+2].[c-]1ccccn1.[c-]1ccccn1
InChIInChI=1S/2C5H4N.Cu/c2*1-2-4-6-5-3-1;/h2*1-4H;/q2*-1;+2
InChIKeyXBFMLUIFTOQCAY-UHFFFAOYSA-N
XLogP1.76
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.73
LogP ≤ 51.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of copper bis(2H-pyridin-2-ide)?
The IUPAC name of copper bis(2H-pyridin-2-ide) (CID 19889065) is copper bis(2H-pyridin-2-ide).
What is the SMILES notation for copper bis(2H-pyridin-2-ide)?
The canonical SMILES for copper bis(2H-pyridin-2-ide) is [Cu+2].[c-]1ccccn1.[c-]1ccccn1.
What is the InChIKey of copper bis(2H-pyridin-2-ide)?
The InChIKey is XBFMLUIFTOQCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/2C5H4N.Cu/c2*1-2-4-6-5-3-1;/h2*1-4H;/q2*-1;+2.
What are the key properties of copper bis(2H-pyridin-2-ide)?
copper bis(2H-pyridin-2-ide) has a molecular weight of 219.73 g/mol, XLogP of 1.76, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for copper bis(2H-pyridin-2-ide) is sourced from PubChem (CID 19889065), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).