lithium 2,2,6,6-tetramethylpiperazin-1-ide

C8H17LiN2 — CID 46220878

IUPAClithium 2,2,6,6-tetramethylpiperazin-1-ide
SMILESCC1(C)CNCC(C)(C)[N-]1.[Li+]
InChIInChI=1S/C8H17N2.Li/c1-7(2)5-9-6-8(3,4)10-7;/h9H,5-6H2,1-4H3;/q-1;+1
InChIKeyHMBIOKWUOXETJS-UHFFFAOYSA-N
MW148.18 g/mol
LogP-1.48
Rot. Bonds

About lithium 2,2,6,6-tetramethylpiperazin-1-ide

lithium 2,2,6,6-tetramethylpiperazin-1-ide (PubChem CID 46220878) has the molecular formula C8H17LiN2 and a molecular weight of 148.18 g/mol. Its IUPAC name is lithium 2,2,6,6-tetramethylpiperazin-1-ide.

Molecular Properties

Compound Namelithium 2,2,6,6-tetramethylpiperazin-1-ide
PubChem CID46220878
Molecular FormulaC8H17LiN2
Molecular Weight148.18 g/mol
Exact Mass148.16
IUPAC Namelithium 2,2,6,6-tetramethylpiperazin-1-ide
SMILESCC1(C)CNCC(C)(C)[N-]1.[Li+]
InChIInChI=1S/C8H17N2.Li/c1-7(2)5-9-6-8(3,4)10-7;/h9H,5-6H2,1-4H3;/q-1;+1
InChIKeyHMBIOKWUOXETJS-UHFFFAOYSA-N
XLogP-1.48
TPSA26.13 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.18
LogP ≤ 5-1.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of lithium 2,2,6,6-tetramethylpiperazin-1-ide?
The IUPAC name of lithium 2,2,6,6-tetramethylpiperazin-1-ide (CID 46220878) is lithium 2,2,6,6-tetramethylpiperazin-1-ide.
What is the SMILES notation for lithium 2,2,6,6-tetramethylpiperazin-1-ide?
The canonical SMILES for lithium 2,2,6,6-tetramethylpiperazin-1-ide is CC1(C)CNCC(C)(C)[N-]1.[Li+].
What is the InChIKey of lithium 2,2,6,6-tetramethylpiperazin-1-ide?
The InChIKey is HMBIOKWUOXETJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17N2.Li/c1-7(2)5-9-6-8(3,4)10-7;/h9H,5-6H2,1-4H3;/q-1;+1.
What are the key properties of lithium 2,2,6,6-tetramethylpiperazin-1-ide?
lithium 2,2,6,6-tetramethylpiperazin-1-ide has a molecular weight of 148.18 g/mol, XLogP of -1.48, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 2,2,6,6-tetramethylpiperazin-1-ide is sourced from PubChem (CID 46220878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).