iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine

C13H9FeN5 — CID 175253430

IUPACiron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine
SMILES[Fe].c1cc(-c2cnccn2)nc(-c2cnccn2)c1
InChIInChI=1S/C13H9N5.Fe/c1-2-10(12-8-14-4-6-16-12)18-11(3-1)13-9-15-5-7-17-13;/h1-9H;
InChIKeyAHZZBXPIMPUOLU-UHFFFAOYSA-N
MW291.10 g/mol
LogP1.99
Rot. Bonds2

About iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine

iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine (PubChem CID 175253430) has the molecular formula C13H9FeN5 and a molecular weight of 291.10 g/mol. Its IUPAC name is iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine.

Molecular Properties

Compound Nameiron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine
PubChem CID175253430
Molecular FormulaC13H9FeN5
Molecular Weight291.10 g/mol
Exact Mass291.02
IUPAC Nameiron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine
SMILES[Fe].c1cc(-c2cnccn2)nc(-c2cnccn2)c1
InChIInChI=1S/C13H9N5.Fe/c1-2-10(12-8-14-4-6-16-12)18-11(3-1)13-9-15-5-7-17-13;/h1-9H;
InChIKeyAHZZBXPIMPUOLU-UHFFFAOYSA-N
XLogP1.99
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.10
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-pyrazin-2-yl-6-pyridin-2-ylpyrazine
CID 174709673
tris(2-pyrazin-2-ylpyrazine);ruthenium(1+)
CID 138986841
5-(chloromethyl)-3-(6-pyrazin-2-yl-2-pyridinyl)-1,2,4-oxadiazole
CID 178100910
2-pyrazin-2-yl-4-pyridin-2-ylpyrimidine
CID 141116052
4-tert-butyl-2-[6-[6-(5-tert-butyl-2-hydroxy-3-pyrazin-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]-6-pyrazin-2-ylphenol
CID 140549433
(4R,5R)-5-(4-fluorophenyl)-4-(6-pyrazin-2-yl-2-pyridinyl)-1,3-oxazolidin-2-one
CID 69281962
2-(2,6-dimethylphenyl)pyrazine
CID 91666747
2-(2-pyridin-2-ylphenyl)pyrazine
CID 91494990
7,16-bis[(6-pyrazin-2-yl-2-pyridinyl)methyl]-1,4,10,13-tetraoxa-7,16-diazacyclooctadecane
CID 14953567
2-[4-(2-methylphenyl)-6-pyridin-2-yl-2-pyridinyl]pyrazine
CID 102074639
2-deuterio-3-pyrazin-2-ylpyrazine
CID 176902269
tetrakis(6-pyrazin-2-ylpyrazin-2-yl)silane
CID 71124248

Frequently Asked Questions

What is the IUPAC name of iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine?
The IUPAC name of iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine (CID 175253430) is iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine.
What is the SMILES notation for iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine?
The canonical SMILES for iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine is [Fe].c1cc(-c2cnccn2)nc(-c2cnccn2)c1.
What is the InChIKey of iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine?
The InChIKey is AHZZBXPIMPUOLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N5.Fe/c1-2-10(12-8-14-4-6-16-12)18-11(3-1)13-9-15-5-7-17-13;/h1-9H;.
What are the key properties of iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine?
iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine has a molecular weight of 291.10 g/mol, XLogP of 1.99, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for iron;2-(6-pyrazin-2-yl-2-pyridinyl)pyrazine is sourced from PubChem (CID 175253430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).