aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide

C21H45AlLiN — CID 11267980

IUPACaluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide
SMILESCC1(C)CCCC(C)(C)[N-]1.[Al+3].[CH2-]C(C)C.[CH2-]C(C)C.[CH2-]C(C)C.[Li+]
InChIInChI=1S/C9H18N.3C4H9.Al.Li/c1-8(2)6-5-7-9(3,4)10-8;3*1-4(2)3;;/h5-7H2,1-4H3;3*4H,1H2,2-3H3;;/q4*-1;+3;+1
InChIKeyVXUMJKRSUKOFHQ-UHFFFAOYSA-N
MW345.52 g/mol
LogP4.15
Rot. Bonds

About aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide

aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide (PubChem CID 11267980) has the molecular formula C21H45AlLiN and a molecular weight of 345.52 g/mol. Its IUPAC name is aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide.

Molecular Properties

Compound Namealuminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide
PubChem CID11267980
Molecular FormulaC21H45AlLiN
Molecular Weight345.52 g/mol
Exact Mass345.35
IUPAC Namealuminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide
SMILESCC1(C)CCCC(C)(C)[N-]1.[Al+3].[CH2-]C(C)C.[CH2-]C(C)C.[CH2-]C(C)C.[Li+]
InChIInChI=1S/C9H18N.3C4H9.Al.Li/c1-8(2)6-5-7-9(3,4)10-8;3*1-4(2)3;;/h5-7H2,1-4H3;3*4H,1H2,2-3H3;;/q4*-1;+3;+1
InChIKeyVXUMJKRSUKOFHQ-UHFFFAOYSA-N
XLogP4.15
TPSA14.10 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.52
LogP ≤ 54.15
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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Related Compounds

cobalt(2+);bis(2,2,6,6-tetramethylpiperidin-1-ide)
CID 140719434
2,2,6,6-tetramethylpiperidin-1-ide;uranium
CID 163645358
lithium;zinc;bis(prop-1-ene);2,2,6,6-tetramethylpiperidin-1-ide
CID 87196986
magnesium;ethane;2,2,6,6-tetramethylpiperidin-1-ide;chloride
CID 143507379
calcium;N,N,N',N'-tetramethylethane-1,2-diamine;bis(2,2,6,6-tetramethylpiperidin-1-ide)
CID 139126310
disodium;buta-1,3-diene;bis(manganese(2+));bis(N,N,N',N'-tetramethylethane-1,2-diamine);tetrakis(2,2,6,6-tetramethylpiperidin-1-ide)
CID 45259027
lithium 2,2,6,6-tetramethylpiperazin-1-ide
CID 46220878
2,2,6,6-tetramethyl-N,N-di(propan-2-yl)piperidin-1-amine
CID 57218894
lithium;hydride;1-methylcyclobutan-1-ol
CID 173114997
1,5-di(propan-2-yl)bicyclo[3.3.3]undecane
CID 177092419
aluminum;dimethylazanide;bis(2-methanidylpropane)
CID 15977879
1,1-dimethylcyclobutane;vanadium
CID 158712416

Frequently Asked Questions

What is the IUPAC name of aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide?
The IUPAC name of aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide (CID 11267980) is aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide.
What is the SMILES notation for aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide?
The canonical SMILES for aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide is CC1(C)CCCC(C)(C)[N-]1.[Al+3].[CH2-]C(C)C.[CH2-]C(C)C.[CH2-]C(C)C.[Li+].
What is the InChIKey of aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide?
The InChIKey is VXUMJKRSUKOFHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N.3C4H9.Al.Li/c1-8(2)6-5-7-9(3,4)10-8;3*1-4(2)3;;/h5-7H2,1-4H3;3*4H,1H2,2-3H3;;/q4*-1;+3;+1.
What are the key properties of aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide?
aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide has a molecular weight of 345.52 g/mol, XLogP of 4.15, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for aluminum;lithium;tris(2-methanidylpropane);2,2,6,6-tetramethylpiperidin-1-ide is sourced from PubChem (CID 11267980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).