tris(pyridine-2-carboxylic acid);vanadium

C18H15N3O6V — CID 15963386

IUPACtris(pyridine-2-carboxylic acid);vanadium
SMILESO=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.[V]
InChIInChI=1S/3C6H5NO2.V/c3*8-6(9)5-3-1-2-4-7-5;/h3*1-4H,(H,8,9);
InChIKeyHOPBJFWLFIOJIG-UHFFFAOYSA-N
MW420.28 g/mol
LogP2.34
Rot. Bonds3

About tris(pyridine-2-carboxylic acid);vanadium

tris(pyridine-2-carboxylic acid);vanadium (PubChem CID 15963386) has the molecular formula C18H15N3O6V and a molecular weight of 420.28 g/mol. Its IUPAC name is tris(pyridine-2-carboxylic acid);vanadium.

Molecular Properties

Compound Nametris(pyridine-2-carboxylic acid);vanadium
PubChem CID15963386
Molecular FormulaC18H15N3O6V
Molecular Weight420.28 g/mol
Exact Mass420.04
IUPAC Nametris(pyridine-2-carboxylic acid);vanadium
SMILESO=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.[V]
InChIInChI=1S/3C6H5NO2.V/c3*8-6(9)5-3-1-2-4-7-5;/h3*1-4H,(H,8,9);
InChIKeyHOPBJFWLFIOJIG-UHFFFAOYSA-N
XLogP2.34
TPSA150.57 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.28
LogP ≤ 52.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of tris(pyridine-2-carboxylic acid);vanadium?
The IUPAC name of tris(pyridine-2-carboxylic acid);vanadium (CID 15963386) is tris(pyridine-2-carboxylic acid);vanadium.
What is the SMILES notation for tris(pyridine-2-carboxylic acid);vanadium?
The canonical SMILES for tris(pyridine-2-carboxylic acid);vanadium is O=C(O)c1ccccn1.O=C(O)c1ccccn1.O=C(O)c1ccccn1.[V].
What is the InChIKey of tris(pyridine-2-carboxylic acid);vanadium?
The InChIKey is HOPBJFWLFIOJIG-UHFFFAOYSA-N. The full InChI is InChI=1S/3C6H5NO2.V/c3*8-6(9)5-3-1-2-4-7-5;/h3*1-4H,(H,8,9);.
What are the key properties of tris(pyridine-2-carboxylic acid);vanadium?
tris(pyridine-2-carboxylic acid);vanadium has a molecular weight of 420.28 g/mol, XLogP of 2.34, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for tris(pyridine-2-carboxylic acid);vanadium is sourced from PubChem (CID 15963386), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).