lithium 5-methanidyl-2-pyridin-2-ylpyridine

C11H9LiN2 — CID 15509438

IUPAClithium 5-methanidyl-2-pyridin-2-ylpyridine
SMILES[CH2-]c1ccc(-c2ccccn2)nc1.[Li+]
InChIInChI=1S/C11H9N2.Li/c1-9-5-6-11(13-8-9)10-4-2-3-7-12-10;/h2-8H,1H2;/q-1;+1
InChIKeySZSQBPLJKRJHIH-UHFFFAOYSA-N
MW176.15 g/mol
LogP-0.67
Rot. Bonds1

About lithium 5-methanidyl-2-pyridin-2-ylpyridine

lithium 5-methanidyl-2-pyridin-2-ylpyridine (PubChem CID 15509438) has the molecular formula C11H9LiN2 and a molecular weight of 176.15 g/mol. Its IUPAC name is lithium 5-methanidyl-2-pyridin-2-ylpyridine.

Molecular Properties

Compound Namelithium 5-methanidyl-2-pyridin-2-ylpyridine
PubChem CID15509438
Molecular FormulaC11H9LiN2
Molecular Weight176.15 g/mol
Exact Mass176.09
IUPAC Namelithium 5-methanidyl-2-pyridin-2-ylpyridine
SMILES[CH2-]c1ccc(-c2ccccn2)nc1.[Li+]
InChIInChI=1S/C11H9N2.Li/c1-9-5-6-11(13-8-9)10-4-2-3-7-12-10;/h2-8H,1H2;/q-1;+1
InChIKeySZSQBPLJKRJHIH-UHFFFAOYSA-N
XLogP-0.67
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.15
LogP ≤ 5-0.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze lithium 5-methanidyl-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

Related Compounds

bis(2-pyridin-2-ylpyridine);ruthenium
CID 87118114
nickel;tris(2-pyridin-2-ylpyridine)
CID 76737267
tris(2-pyridin-2-ylpyridine);ruthenium
CID 6100643
2-pyridin-2-ylpyridine;ruthenium(2+)
CID 140596360
2-pyridin-2-ylpyridine;hydroiodide
CID 172833113
2-pyridin-2-ylpyridine;rhenium;tetrachloride
CID 52939847
2-pyridin-2-ylpyridine;dihydroiodide
CID 173445353
disodium;hydride;2-pyridin-2-ylpyridine
CID 174959125
pyrrolo[3,2-b]azepine
CID 66934182
iridium;2-pyridin-2-ylpyridine;ruthenium
CID 174707743
6-(5-pyridin-2-ylpyrazin-2-yl)pyridine-3-thiol
CID 136854518
2-pyridin-2-yl-5-[2-(6-pyridin-2-yl-3-pyridinyl)ethyl]pyridine
CID 102191368

Frequently Asked Questions

What is the IUPAC name of lithium 5-methanidyl-2-pyridin-2-ylpyridine?
The IUPAC name of lithium 5-methanidyl-2-pyridin-2-ylpyridine (CID 15509438) is lithium 5-methanidyl-2-pyridin-2-ylpyridine.
What is the SMILES notation for lithium 5-methanidyl-2-pyridin-2-ylpyridine?
The canonical SMILES for lithium 5-methanidyl-2-pyridin-2-ylpyridine is [CH2-]c1ccc(-c2ccccn2)nc1.[Li+].
What is the InChIKey of lithium 5-methanidyl-2-pyridin-2-ylpyridine?
The InChIKey is SZSQBPLJKRJHIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N2.Li/c1-9-5-6-11(13-8-9)10-4-2-3-7-12-10;/h2-8H,1H2;/q-1;+1.
What are the key properties of lithium 5-methanidyl-2-pyridin-2-ylpyridine?
lithium 5-methanidyl-2-pyridin-2-ylpyridine has a molecular weight of 176.15 g/mol, XLogP of -0.67, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 5-methanidyl-2-pyridin-2-ylpyridine is sourced from PubChem (CID 15509438), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).