1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+)

C9H10N2Ru — CID 87611518

IUPAC1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+)
SMILESCC1=[C-]CC=C1.[Ru+2].[c-]1ncc[nH]1
InChIInChI=1S/C6H7.C3H3N2.Ru/c1-6-4-2-3-5-6;1-2-5-3-4-1;/h2,4H,3H2,1H3;1-2H,(H,4,5);/q2*-1;+2
InChIKeyZSBXIMTVMOIRFU-UHFFFAOYSA-N
MW247.26 g/mol
LogP1.90
Rot. Bonds

About 1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+)

1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+) (PubChem CID 87611518) has the molecular formula C9H10N2Ru and a molecular weight of 247.26 g/mol. Its IUPAC name is 1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+).

Molecular Properties

Compound Name1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+)
PubChem CID87611518
Molecular FormulaC9H10N2Ru
Molecular Weight247.26 g/mol
Exact Mass247.99
IUPAC Name1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+)
SMILESCC1=[C-]CC=C1.[Ru+2].[c-]1ncc[nH]1
InChIInChI=1S/C6H7.C3H3N2.Ru/c1-6-4-2-3-5-6;1-2-5-3-4-1;/h2,4H,3H2,1H3;1-2H,(H,4,5);/q2*-1;+2
InChIKeyZSBXIMTVMOIRFU-UHFFFAOYSA-N
XLogP1.90
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+)?
The IUPAC name of 1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+) (CID 87611518) is 1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+).
What is the SMILES notation for 1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+)?
The canonical SMILES for 1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+) is CC1=[C-]CC=C1.[Ru+2].[c-]1ncc[nH]1.
What is the InChIKey of 1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+)?
The InChIKey is ZSBXIMTVMOIRFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7.C3H3N2.Ru/c1-6-4-2-3-5-6;1-2-5-3-4-1;/h2,4H,3H2,1H3;1-2H,(H,4,5);/q2*-1;+2.
What are the key properties of 1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+)?
1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+) has a molecular weight of 247.26 g/mol, XLogP of 1.90, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dihydroimidazol-2-ide;2-methylcyclopenta-1,3-diene;ruthenium(2+) is sourced from PubChem (CID 87611518), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).