lithium dibutylazanide

C8H18LiN — CID 10953567

IUPAClithium dibutylazanide
SMILESCCCC[N-]CCCC.[Li+]
InChIInChI=1S/C8H18N.Li/c1-3-5-7-9-8-6-4-2;/h3-8H2,1-2H3;/q-1;+1
InChIKeyNVMMPHVQFFIBOS-UHFFFAOYSA-N
MW135.18 g/mol
LogP-0.04
Rot. Bonds6

About lithium dibutylazanide

lithium dibutylazanide (PubChem CID 10953567) has the molecular formula C8H18LiN and a molecular weight of 135.18 g/mol. Its IUPAC name is lithium dibutylazanide.

Molecular Properties

Compound Namelithium dibutylazanide
PubChem CID10953567
Molecular FormulaC8H18LiN
Molecular Weight135.18 g/mol
Exact Mass135.16
IUPAC Namelithium dibutylazanide
SMILESCCCC[N-]CCCC.[Li+]
InChIInChI=1S/C8H18N.Li/c1-3-5-7-9-8-6-4-2;/h3-8H2,1-2H3;/q-1;+1
InChIKeyNVMMPHVQFFIBOS-UHFFFAOYSA-N
XLogP-0.04
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds6
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.18
LogP ≤ 5-0.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of lithium dibutylazanide?
The IUPAC name of lithium dibutylazanide (CID 10953567) is lithium dibutylazanide.
What is the SMILES notation for lithium dibutylazanide?
The canonical SMILES for lithium dibutylazanide is CCCC[N-]CCCC.[Li+].
What is the InChIKey of lithium dibutylazanide?
The InChIKey is NVMMPHVQFFIBOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N.Li/c1-3-5-7-9-8-6-4-2;/h3-8H2,1-2H3;/q-1;+1.
What are the key properties of lithium dibutylazanide?
lithium dibutylazanide has a molecular weight of 135.18 g/mol, XLogP of -0.04, 6 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium dibutylazanide is sourced from PubChem (CID 10953567), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).