lithium;N-hexylethanimine;hydride

C8H18LiN — CID 174719664

IUPAClithium;N-hexylethanimine;hydride
SMILESC/C=N/CCCCCC.[H-].[Li+]
InChIInChI=1S/C8H17N.Li.H/c1-3-5-6-7-8-9-4-2;;/h4H,3,5-8H2,1-2H3;;/q;+1;-1/b9-4+;;
InChIKeyKIEZAAXEIZSDRL-HPJBNNNXSA-N
MW135.18 g/mol
LogP-0.23
Rot. Bonds5

About lithium;N-hexylethanimine;hydride

lithium;N-hexylethanimine;hydride (PubChem CID 174719664) has the molecular formula C8H18LiN and a molecular weight of 135.18 g/mol. Its IUPAC name is lithium;N-hexylethanimine;hydride.

Molecular Properties

Compound Namelithium;N-hexylethanimine;hydride
PubChem CID174719664
Molecular FormulaC8H18LiN
Molecular Weight135.18 g/mol
Exact Mass135.16
IUPAC Namelithium;N-hexylethanimine;hydride
SMILESC/C=N/CCCCCC.[H-].[Li+]
InChIInChI=1S/C8H17N.Li.H/c1-3-5-6-7-8-9-4-2;;/h4H,3,5-8H2,1-2H3;;/q;+1;-1/b9-4+;;
InChIKeyKIEZAAXEIZSDRL-HPJBNNNXSA-N
XLogP-0.23
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.18
LogP ≤ 5-0.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-butylethanimine;ethane
CID 142024896
(E)-N-octylbut-2-en-1-imine
CID 167240064
trilithium;hydride;icosane
CID 173415382
lithium;dodecane;hydride
CID 173115706
N-pentacosylhexacosan-1-imine
CID 21412184
N-hexacosylheptacosan-1-imine
CID 88829034
N,N'-didecylpentane-1,5-diimine
CID 118371796
N-hexyldecan-1-imine
CID 174719675
N-tetradecyltridecan-1-imine
CID 175147598
N-octylprop-2-en-1-imine
CID 174329856
tetralithium;hexane;hydride
CID 174784043
2-tetradecyliminoacetic acid
CID 88692071

Frequently Asked Questions

What is the IUPAC name of lithium;N-hexylethanimine;hydride?
The IUPAC name of lithium;N-hexylethanimine;hydride (CID 174719664) is lithium;N-hexylethanimine;hydride.
What is the SMILES notation for lithium;N-hexylethanimine;hydride?
The canonical SMILES for lithium;N-hexylethanimine;hydride is C/C=N/CCCCCC.[H-].[Li+].
What is the InChIKey of lithium;N-hexylethanimine;hydride?
The InChIKey is KIEZAAXEIZSDRL-HPJBNNNXSA-N. The full InChI is InChI=1S/C8H17N.Li.H/c1-3-5-6-7-8-9-4-2;;/h4H,3,5-8H2,1-2H3;;/q;+1;-1/b9-4+;;.
What are the key properties of lithium;N-hexylethanimine;hydride?
lithium;N-hexylethanimine;hydride has a molecular weight of 135.18 g/mol, XLogP of -0.23, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;N-hexylethanimine;hydride is sourced from PubChem (CID 174719664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).