lithium methylcyclobutane

C5H9Li — CID 18798510

IUPAClithium methylcyclobutane
SMILESC[C-]1CCC1.[Li+]
InChIInChI=1S/C5H9.Li/c1-5-3-2-4-5;/h2-4H2,1H3;/q-1;+1
InChIKeyIJDZHAPYXSCVIC-UHFFFAOYSA-N
MW76.07 g/mol
LogP-1.23
Rot. Bonds

About lithium methylcyclobutane

lithium methylcyclobutane (PubChem CID 18798510) has the molecular formula C5H9Li and a molecular weight of 76.07 g/mol. Its IUPAC name is lithium methylcyclobutane.

Molecular Properties

Compound Namelithium methylcyclobutane
PubChem CID18798510
Molecular FormulaC5H9Li
Molecular Weight76.07 g/mol
Exact Mass76.09
IUPAC Namelithium methylcyclobutane
SMILESC[C-]1CCC1.[Li+]
InChIInChI=1S/C5H9.Li/c1-5-3-2-4-5;/h2-4H2,1H3;/q-1;+1
InChIKeyIJDZHAPYXSCVIC-UHFFFAOYSA-N
XLogP-1.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50076.07
LogP ≤ 5-1.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium methylcyclobutane?
The IUPAC name of lithium methylcyclobutane (CID 18798510) is lithium methylcyclobutane.
What is the SMILES notation for lithium methylcyclobutane?
The canonical SMILES for lithium methylcyclobutane is C[C-]1CCC1.[Li+].
What is the InChIKey of lithium methylcyclobutane?
The InChIKey is IJDZHAPYXSCVIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9.Li/c1-5-3-2-4-5;/h2-4H2,1H3;/q-1;+1.
What are the key properties of lithium methylcyclobutane?
lithium methylcyclobutane has a molecular weight of 76.07 g/mol, XLogP of -1.23, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium methylcyclobutane is sourced from PubChem (CID 18798510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).