tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+)

C36H27N6O12U — CID 134822610

IUPACtris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+)
SMILESO=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.[U+3]
InChIInChI=1S/6C6H5NO2.U/c6*8-6(9)5-3-1-2-4-7-5;/h6*1-4H,(H,8,9);/q;;;;;;+3/p-3
InChIKeyGIZGVNMOSGVLEZ-UHFFFAOYSA-K
MW973.67 g/mol
LogP0.67
Rot. Bonds6

About tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+)

tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+) (PubChem CID 134822610) has the molecular formula C36H27N6O12U and a molecular weight of 973.67 g/mol. Its IUPAC name is tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+).

Molecular Properties

Compound Nametris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+)
PubChem CID134822610
Molecular FormulaC36H27N6O12U
Molecular Weight973.67 g/mol
Exact Mass973.22
IUPAC Nametris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+)
SMILESO=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.[U+3]
InChIInChI=1S/6C6H5NO2.U/c6*8-6(9)5-3-1-2-4-7-5;/h6*1-4H,(H,8,9);/q;;;;;;+3/p-3
InChIKeyGIZGVNMOSGVLEZ-UHFFFAOYSA-K
XLogP0.67
TPSA309.63 Ų
H-Bond Donors3
H-Bond Acceptors15
Rotatable Bonds6
Heavy Atoms55
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500973.67
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1015

Analyze tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+) 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 tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+)?
The IUPAC name of tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+) (CID 134822610) is tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+).
What is the SMILES notation for tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+)?
The canonical SMILES for tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+) is O=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.O=C([O-])c1ccccn1.[U+3].
What is the InChIKey of tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+)?
The InChIKey is GIZGVNMOSGVLEZ-UHFFFAOYSA-K. The full InChI is InChI=1S/6C6H5NO2.U/c6*8-6(9)5-3-1-2-4-7-5;/h6*1-4H,(H,8,9);/q;;;;;;+3/p-3.
What are the key properties of tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+)?
tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+) has a molecular weight of 973.67 g/mol, XLogP of 0.67, 6 rotatable bonds, 3 hydrogen bond donors, and 15 hydrogen bond acceptors.
Where does this data come from?
All data for tris(pyridine-2-carboxylate);tris(pyridine-2-carboxylic acid);uranium(3+) is sourced from PubChem (CID 134822610), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).