zinc;carbanide;2H-pyridin-2-ide

C6H7NZn — CID 58614898

IUPACzinc;carbanide;2H-pyridin-2-ide
SMILES[CH3-].[Zn+2].[c-]1ccccn1
InChIInChI=1S/C5H4N.CH3.Zn/c1-2-4-6-5-3-1;;/h1-4H;1H3;/q2*-1;+2
InChIKeyCTKADTNTRFDHQO-UHFFFAOYSA-N
MW158.52 g/mol
LogP1.33
Rot. Bonds

About zinc;carbanide;2H-pyridin-2-ide

zinc;carbanide;2H-pyridin-2-ide (PubChem CID 58614898) has the molecular formula C6H7NZn and a molecular weight of 158.52 g/mol. Its IUPAC name is zinc;carbanide;2H-pyridin-2-ide.

Molecular Properties

Compound Namezinc;carbanide;2H-pyridin-2-ide
PubChem CID58614898
Molecular FormulaC6H7NZn
Molecular Weight158.52 g/mol
Exact Mass156.99
IUPAC Namezinc;carbanide;2H-pyridin-2-ide
SMILES[CH3-].[Zn+2].[c-]1ccccn1
InChIInChI=1S/C5H4N.CH3.Zn/c1-2-4-6-5-3-1;;/h1-4H;1H3;/q2*-1;+2
InChIKeyCTKADTNTRFDHQO-UHFFFAOYSA-N
XLogP1.33
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.52
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-Pyridyl zinc bromide
CID 6414715
2-Pyridylmagnesium bromide
CID 10888579
Azocine
CID 6451481
Lithium, 3-pyridinyl-
CID 11126177
2-Pyridyllithium
CID 12327865
Lithium pyridin-4-ide
CID 13014695
Potassium pyridin-4-ide
CID 71428983
Pyridylcopper
CID 12761937
Chlorozinc(1+) pyridin-2-ide
CID 12931150
Chlorozinc(1+) pyridin-3-ide
CID 12931151
Bis(imino)pyridyl iron
CID 18474454
3-Pyridylzinc bromide
CID 23592000

Frequently Asked Questions

What is the IUPAC name of zinc;carbanide;2H-pyridin-2-ide?
The IUPAC name of zinc;carbanide;2H-pyridin-2-ide (CID 58614898) is zinc;carbanide;2H-pyridin-2-ide.
What is the SMILES notation for zinc;carbanide;2H-pyridin-2-ide?
The canonical SMILES for zinc;carbanide;2H-pyridin-2-ide is [CH3-].[Zn+2].[c-]1ccccn1.
What is the InChIKey of zinc;carbanide;2H-pyridin-2-ide?
The InChIKey is CTKADTNTRFDHQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H4N.CH3.Zn/c1-2-4-6-5-3-1;;/h1-4H;1H3;/q2*-1;+2.
What are the key properties of zinc;carbanide;2H-pyridin-2-ide?
zinc;carbanide;2H-pyridin-2-ide has a molecular weight of 158.52 g/mol, XLogP of 1.33, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for zinc;carbanide;2H-pyridin-2-ide is sourced from PubChem (CID 58614898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).