2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+)

C9H10N2Ru — CID 87512404

IUPAC2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+)
SMILESCc1ccc[n-]1.[Ru+2].c1cc[n-]c1
InChIInChI=1S/C5H6N.C4H4N.Ru/c1-5-3-2-4-6-5;1-2-4-5-3-1;/h2-4H,1H3;1-4H;/q2*-1;+2
InChIKeyWATMQDCLSVXUFB-UHFFFAOYSA-N
MW247.26 g/mol
LogP1.59
Rot. Bonds

About 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+)

2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+) (PubChem CID 87512404) has the molecular formula C9H10N2Ru and a molecular weight of 247.26 g/mol. Its IUPAC name is 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+).

Molecular Properties

Compound Name2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+)
PubChem CID87512404
Molecular FormulaC9H10N2Ru
Molecular Weight247.26 g/mol
Exact Mass247.99
IUPAC Name2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+)
SMILESCc1ccc[n-]1.[Ru+2].c1cc[n-]c1
InChIInChI=1S/C5H6N.C4H4N.Ru/c1-5-3-2-4-6-5;1-2-4-5-3-1;/h2-4H,1H3;1-4H;/q2*-1;+2
InChIKeyWATMQDCLSVXUFB-UHFFFAOYSA-N
XLogP1.59
TPSA28.20 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.26
LogP ≤ 51.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+) with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+)?
The IUPAC name of 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+) (CID 87512404) is 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+).
What is the SMILES notation for 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+)?
The canonical SMILES for 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+) is Cc1ccc[n-]1.[Ru+2].c1cc[n-]c1.
What is the InChIKey of 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+)?
The InChIKey is WATMQDCLSVXUFB-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N.C4H4N.Ru/c1-5-3-2-4-6-5;1-2-4-5-3-1;/h2-4H,1H3;1-4H;/q2*-1;+2.
What are the key properties of 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+)?
2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+) has a molecular weight of 247.26 g/mol, XLogP of 1.59, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methylpyrrol-1-ide;pyrrol-1-ide;ruthenium(2+) is sourced from PubChem (CID 87512404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).