chromium(2+);tris(2-pyridin-2-ylpyridine)

C30H24CrN6+2 — CID 3082120

IUPACchromium(2+);tris(2-pyridin-2-ylpyridine)
SMILES[Cr+2].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/3C10H8N2.Cr/c3*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h3*1-8H;/q;;;+2
InChIKeyDKLDNRKSVNPCKM-UHFFFAOYSA-N
MW520.56 g/mol
LogP6.43
Rot. Bonds3

About chromium(2+);tris(2-pyridin-2-ylpyridine)

chromium(2+);tris(2-pyridin-2-ylpyridine) (PubChem CID 3082120) has the molecular formula C30H24CrN6+2 and a molecular weight of 520.56 g/mol. Its IUPAC name is chromium(2+);tris(2-pyridin-2-ylpyridine).

Molecular Properties

Compound Namechromium(2+);tris(2-pyridin-2-ylpyridine)
PubChem CID3082120
Molecular FormulaC30H24CrN6+2
Molecular Weight520.56 g/mol
Exact Mass520.15
IUPAC Namechromium(2+);tris(2-pyridin-2-ylpyridine)
SMILES[Cr+2].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1
InChIInChI=1S/3C10H8N2.Cr/c3*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h3*1-8H;/q;;;+2
InChIKeyDKLDNRKSVNPCKM-UHFFFAOYSA-N
XLogP6.43
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms37
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500520.56
LogP ≤ 56.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze chromium(2+);tris(2-pyridin-2-ylpyridine) 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 chromium(2+);tris(2-pyridin-2-ylpyridine)?
The IUPAC name of chromium(2+);tris(2-pyridin-2-ylpyridine) (CID 3082120) is chromium(2+);tris(2-pyridin-2-ylpyridine).
What is the SMILES notation for chromium(2+);tris(2-pyridin-2-ylpyridine)?
The canonical SMILES for chromium(2+);tris(2-pyridin-2-ylpyridine) is [Cr+2].c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.c1ccc(-c2ccccn2)nc1.
What is the InChIKey of chromium(2+);tris(2-pyridin-2-ylpyridine)?
The InChIKey is DKLDNRKSVNPCKM-UHFFFAOYSA-N. The full InChI is InChI=1S/3C10H8N2.Cr/c3*1-3-7-11-9(5-1)10-6-2-4-8-12-10;/h3*1-8H;/q;;;+2.
What are the key properties of chromium(2+);tris(2-pyridin-2-ylpyridine)?
chromium(2+);tris(2-pyridin-2-ylpyridine) has a molecular weight of 520.56 g/mol, XLogP of 6.43, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for chromium(2+);tris(2-pyridin-2-ylpyridine) is sourced from PubChem (CID 3082120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).