pyridine-2,3-diimine;vanadium

C5H5N3V — CID 157242379

IUPACpyridine-2,3-diimine;vanadium
SMILES[H]/N=C1\N=CC=C\C1=N/[H].[V]
InChIInChI=1S/C5H5N3.V/c6-4-2-1-3-8-5(4)7;/h1-3,6-7H;/b6-4+,7-5-;
InChIKeyRNPNXXAQEQCEDQ-XGGDKXJTSA-N
MW158.06 g/mol
LogP0.62
Rot. Bonds

About pyridine-2,3-diimine;vanadium

pyridine-2,3-diimine;vanadium (PubChem CID 157242379) has the molecular formula C5H5N3V and a molecular weight of 158.06 g/mol. Its IUPAC name is pyridine-2,3-diimine;vanadium.

Molecular Properties

Compound Namepyridine-2,3-diimine;vanadium
PubChem CID157242379
Molecular FormulaC5H5N3V
Molecular Weight158.06 g/mol
Exact Mass157.99
IUPAC Namepyridine-2,3-diimine;vanadium
SMILES[H]/N=C1\N=CC=C\C1=N/[H].[V]
InChIInChI=1S/C5H5N3.V/c6-4-2-1-3-8-5(4)7;/h1-3,6-7H;/b6-4+,7-5-;
InChIKeyRNPNXXAQEQCEDQ-XGGDKXJTSA-N
XLogP0.62
TPSA60.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.06
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of pyridine-2,3-diimine;vanadium?
The IUPAC name of pyridine-2,3-diimine;vanadium (CID 157242379) is pyridine-2,3-diimine;vanadium.
What is the SMILES notation for pyridine-2,3-diimine;vanadium?
The canonical SMILES for pyridine-2,3-diimine;vanadium is [H]/N=C1\N=CC=C\C1=N/[H].[V].
What is the InChIKey of pyridine-2,3-diimine;vanadium?
The InChIKey is RNPNXXAQEQCEDQ-XGGDKXJTSA-N. The full InChI is InChI=1S/C5H5N3.V/c6-4-2-1-3-8-5(4)7;/h1-3,6-7H;/b6-4+,7-5-;.
What are the key properties of pyridine-2,3-diimine;vanadium?
pyridine-2,3-diimine;vanadium has a molecular weight of 158.06 g/mol, XLogP of 0.62, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for pyridine-2,3-diimine;vanadium is sourced from PubChem (CID 157242379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).