1H-imidazole;ruthenium(2+)

C3H4N2Ru+2 — CID 23025261

IUPAC1H-imidazole;ruthenium(2+)
SMILES[Ru+2].c1c[nH]cn1
InChIInChI=1S/C3H4N2.Ru/c1-2-5-3-4-1;/h1-3H,(H,4,5);/q;+2
InChIKeyFKJBHGDQNXJEMB-UHFFFAOYSA-N
MW169.15 g/mol
LogP0.41
Rot. Bonds

About 1H-imidazole;ruthenium(2+)

1H-imidazole;ruthenium(2+) (PubChem CID 23025261) has the molecular formula C3H4N2Ru+2 and a molecular weight of 169.15 g/mol. Its IUPAC name is 1H-imidazole;ruthenium(2+).

Molecular Properties

Compound Name1H-imidazole;ruthenium(2+)
PubChem CID23025261
Molecular FormulaC3H4N2Ru+2
Molecular Weight169.15 g/mol
Exact Mass169.94
IUPAC Name1H-imidazole;ruthenium(2+)
SMILES[Ru+2].c1c[nH]cn1
InChIInChI=1S/C3H4N2.Ru/c1-2-5-3-4-1;/h1-3H,(H,4,5);/q;+2
InChIKeyFKJBHGDQNXJEMB-UHFFFAOYSA-N
XLogP0.41
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.15
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1H-imidazole;ruthenium(2+)?
The IUPAC name of 1H-imidazole;ruthenium(2+) (CID 23025261) is 1H-imidazole;ruthenium(2+).
What is the SMILES notation for 1H-imidazole;ruthenium(2+)?
The canonical SMILES for 1H-imidazole;ruthenium(2+) is [Ru+2].c1c[nH]cn1.
What is the InChIKey of 1H-imidazole;ruthenium(2+)?
The InChIKey is FKJBHGDQNXJEMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H4N2.Ru/c1-2-5-3-4-1;/h1-3H,(H,4,5);/q;+2.
What are the key properties of 1H-imidazole;ruthenium(2+)?
1H-imidazole;ruthenium(2+) has a molecular weight of 169.15 g/mol, XLogP of 0.41, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-imidazole;ruthenium(2+) is sourced from PubChem (CID 23025261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).