lithium 2-methylidenepyridin-1-ide

C6H6LiN — CID 23690258

IUPAClithium 2-methylidenepyridin-1-ide
SMILESC=C1C=CC=C[N-]1.[Li+]
InChIInChI=1S/C6H6N.Li/c1-6-4-2-3-5-7-6;/h2-5H,1H2;/q-1;+1
InChIKeyBEBIQSRTLZBRRT-UHFFFAOYSA-N
MW99.06 g/mol
LogP-1.04
Rot. Bonds

About lithium 2-methylidenepyridin-1-ide

lithium 2-methylidenepyridin-1-ide (PubChem CID 23690258) has the molecular formula C6H6LiN and a molecular weight of 99.06 g/mol. Its IUPAC name is lithium 2-methylidenepyridin-1-ide.

Molecular Properties

Compound Namelithium 2-methylidenepyridin-1-ide
PubChem CID23690258
Molecular FormulaC6H6LiN
Molecular Weight99.06 g/mol
Exact Mass99.07
IUPAC Namelithium 2-methylidenepyridin-1-ide
SMILESC=C1C=CC=C[N-]1.[Li+]
InChIInChI=1S/C6H6N.Li/c1-6-4-2-3-5-7-6;/h2-5H,1H2;/q-1;+1
InChIKeyBEBIQSRTLZBRRT-UHFFFAOYSA-N
XLogP-1.04
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50099.06
LogP ≤ 5-1.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of lithium 2-methylidenepyridin-1-ide?
The IUPAC name of lithium 2-methylidenepyridin-1-ide (CID 23690258) is lithium 2-methylidenepyridin-1-ide.
What is the SMILES notation for lithium 2-methylidenepyridin-1-ide?
The canonical SMILES for lithium 2-methylidenepyridin-1-ide is C=C1C=CC=C[N-]1.[Li+].
What is the InChIKey of lithium 2-methylidenepyridin-1-ide?
The InChIKey is BEBIQSRTLZBRRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N.Li/c1-6-4-2-3-5-7-6;/h2-5H,1H2;/q-1;+1.
What are the key properties of lithium 2-methylidenepyridin-1-ide?
lithium 2-methylidenepyridin-1-ide has a molecular weight of 99.06 g/mol, XLogP of -1.04, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 2-methylidenepyridin-1-ide is sourced from PubChem (CID 23690258), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).