copper N-phenylpyridin-1-id-2-imine

C11H8CuN2 — CID 134857612

IUPACcopper N-phenylpyridin-1-id-2-imine
SMILES[Cu+2].[c-]1ccccc1/N=c1/cccc[n-]1
InChIInChI=1S/C11H8N2.Cu/c1-2-6-10(7-3-1)13-11-8-4-5-9-12-11;/h1-6,8-9H;/q-2;+2
InChIKeyLBNGMDWLZGEQNW-UHFFFAOYSA-N
MW231.75 g/mol
LogP1.67
Rot. Bonds1

About copper N-phenylpyridin-1-id-2-imine

copper N-phenylpyridin-1-id-2-imine (PubChem CID 134857612) has the molecular formula C11H8CuN2 and a molecular weight of 231.75 g/mol. Its IUPAC name is copper N-phenylpyridin-1-id-2-imine.

Molecular Properties

Compound Namecopper N-phenylpyridin-1-id-2-imine
PubChem CID134857612
Molecular FormulaC11H8CuN2
Molecular Weight231.75 g/mol
Exact Mass231.00
IUPAC Namecopper N-phenylpyridin-1-id-2-imine
SMILES[Cu+2].[c-]1ccccc1/N=c1/cccc[n-]1
InChIInChI=1S/C11H8N2.Cu/c1-2-6-10(7-3-1)13-11-8-4-5-9-12-11;/h1-6,8-9H;/q-2;+2
InChIKeyLBNGMDWLZGEQNW-UHFFFAOYSA-N
XLogP1.67
TPSA26.46 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.75
LogP ≤ 51.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

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iridium;phenylbenzene
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1-phenyl-4-[4-[4-(4-phenylbenzene-3,6-diid-1-yl)benzene-3,6-diid-1-yl]benzene-3,6-diid-1-yl]benzene-3,6-diide;pentakis(yttrium)
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Frequently Asked Questions

What is the IUPAC name of copper N-phenylpyridin-1-id-2-imine?
The IUPAC name of copper N-phenylpyridin-1-id-2-imine (CID 134857612) is copper N-phenylpyridin-1-id-2-imine.
What is the SMILES notation for copper N-phenylpyridin-1-id-2-imine?
The canonical SMILES for copper N-phenylpyridin-1-id-2-imine is [Cu+2].[c-]1ccccc1/N=c1/cccc[n-]1.
What is the InChIKey of copper N-phenylpyridin-1-id-2-imine?
The InChIKey is LBNGMDWLZGEQNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N2.Cu/c1-2-6-10(7-3-1)13-11-8-4-5-9-12-11;/h1-6,8-9H;/q-2;+2.
What are the key properties of copper N-phenylpyridin-1-id-2-imine?
copper N-phenylpyridin-1-id-2-imine has a molecular weight of 231.75 g/mol, XLogP of 1.67, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for copper N-phenylpyridin-1-id-2-imine is sourced from PubChem (CID 134857612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).