lithium pyrazol-1-ide

C3H3LiN2 — CID 15148462

IUPAClithium pyrazol-1-ide
SMILES[Li+].c1cn[n-]c1
InChIInChI=1S/C3H3N2.Li/c1-2-4-5-3-1;/h1-3H;/q-1;+1
InChIKeyZDPOGNZUYGOOEI-UHFFFAOYSA-N
MW74.01 g/mol
LogP-2.96
Rot. Bonds

About lithium pyrazol-1-ide

lithium pyrazol-1-ide (PubChem CID 15148462) has the molecular formula C3H3LiN2 and a molecular weight of 74.01 g/mol. Its IUPAC name is lithium pyrazol-1-ide.

Molecular Properties

Compound Namelithium pyrazol-1-ide
PubChem CID15148462
Molecular FormulaC3H3LiN2
Molecular Weight74.01 g/mol
Exact Mass74.05
IUPAC Namelithium pyrazol-1-ide
SMILES[Li+].c1cn[n-]c1
InChIInChI=1S/C3H3N2.Li/c1-2-4-5-3-1;/h1-3H;/q-1;+1
InChIKeyZDPOGNZUYGOOEI-UHFFFAOYSA-N
XLogP-2.96
TPSA26.99 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50074.01
LogP ≤ 5-2.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of lithium pyrazol-1-ide?
The IUPAC name of lithium pyrazol-1-ide (CID 15148462) is lithium pyrazol-1-ide.
What is the SMILES notation for lithium pyrazol-1-ide?
The canonical SMILES for lithium pyrazol-1-ide is [Li+].c1cn[n-]c1.
What is the InChIKey of lithium pyrazol-1-ide?
The InChIKey is ZDPOGNZUYGOOEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3N2.Li/c1-2-4-5-3-1;/h1-3H;/q-1;+1.
What are the key properties of lithium pyrazol-1-ide?
lithium pyrazol-1-ide has a molecular weight of 74.01 g/mol, XLogP of -2.96, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium pyrazol-1-ide is sourced from PubChem (CID 15148462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).