lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide

C9H18LiN — CID 101048200

IUPAClithium 2,2,4,4-tetramethylpentan-3-ylideneazanide
SMILESCC(C)(C)C(=[N-])C(C)(C)C.[Li+]
InChIInChI=1S/C9H18N.Li/c1-8(2,3)7(10)9(4,5)6;/h1-6H3;/q-1;+1
InChIKeyOKBBWWUVUMKOMH-UHFFFAOYSA-N
MW147.19 g/mol
LogP0.09
Rot. Bonds

About lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide

lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide (PubChem CID 101048200) has the molecular formula C9H18LiN and a molecular weight of 147.19 g/mol. Its IUPAC name is lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide.

Molecular Properties

Compound Namelithium 2,2,4,4-tetramethylpentan-3-ylideneazanide
PubChem CID101048200
Molecular FormulaC9H18LiN
Molecular Weight147.19 g/mol
Exact Mass147.16
IUPAC Namelithium 2,2,4,4-tetramethylpentan-3-ylideneazanide
SMILESCC(C)(C)C(=[N-])C(C)(C)C.[Li+]
InChIInChI=1S/C9H18N.Li/c1-8(2,3)7(10)9(4,5)6;/h1-6H3;/q-1;+1
InChIKeyOKBBWWUVUMKOMH-UHFFFAOYSA-N
XLogP0.09
TPSA22.30 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.19
LogP ≤ 50.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

2,2,4,4-Tetramethyl-3-pentanone Imine
CID 2755632
3-Diazo-2,2,4,4-tetramethylpentane
CID 638177
(E)-N-[(Z)-2,2-dimethylpentan-3-ylideneamino]-2,2-dimethylpentan-3-imine
CID 59873286
(2,2,4,4-Tetramethylpentan-3-ylideneamino) thiohypochlorite
CID 86215016
(E)-N-[(Z)-4,4-dimethylpentan-2-ylideneamino]-4,4-dimethylpentan-2-imine
CID 134897223
N-fluoro-2,2,4,4-tetramethylpentan-3-imine
CID 23235944
2,2,4,4-Tetramethylpentan-3-ylideneazanium
CID 7019373
N-tert-butyl-2,2,4,4-tetramethylpentan-3-imine
CID 12682622
N,2,2,4,4-pentamethylpentan-3-imine
CID 20684885
2-Methylpropane;2,2,5,5-tetramethylhexan-3-ylideneazanide;yttrium
CID 58488616
5,5-Dimethylhexan-2-ylideneazanide;yttrium
CID 58687817
CID 102062250
CID 102062250

Frequently Asked Questions

What is the IUPAC name of lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide?
The IUPAC name of lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide (CID 101048200) is lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide.
What is the SMILES notation for lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide?
The canonical SMILES for lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide is CC(C)(C)C(=[N-])C(C)(C)C.[Li+].
What is the InChIKey of lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide?
The InChIKey is OKBBWWUVUMKOMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N.Li/c1-8(2,3)7(10)9(4,5)6;/h1-6H3;/q-1;+1.
What are the key properties of lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide?
lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide has a molecular weight of 147.19 g/mol, XLogP of 0.09, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 2,2,4,4-tetramethylpentan-3-ylideneazanide is sourced from PubChem (CID 101048200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).