lithium;copper(1+);2-methylbut-2-ene;cyanide

C6H9CuLiN — CID 134949546

IUPAClithium;copper(1+);2-methylbut-2-ene;cyanide
SMILES[C-]#N.[CH2-]C=C(C)C.[Cu+].[Li+]
InChIInChI=1S/C5H9.CN.Cu.Li/c1-4-5(2)3;1-2;;/h4H,1H2,2-3H3;;;/q2*-1;2*+1
InChIKeySYOYGPNGXNNVNP-UHFFFAOYSA-N
MW165.63 g/mol
LogP-1.12
Rot. Bonds

About lithium;copper(1+);2-methylbut-2-ene;cyanide

lithium;copper(1+);2-methylbut-2-ene;cyanide (PubChem CID 134949546) has the molecular formula C6H9CuLiN and a molecular weight of 165.63 g/mol. Its IUPAC name is lithium;copper(1+);2-methylbut-2-ene;cyanide.

Molecular Properties

Compound Namelithium;copper(1+);2-methylbut-2-ene;cyanide
PubChem CID134949546
Molecular FormulaC6H9CuLiN
Molecular Weight165.63 g/mol
Exact Mass165.02
IUPAC Namelithium;copper(1+);2-methylbut-2-ene;cyanide
SMILES[C-]#N.[CH2-]C=C(C)C.[Cu+].[Li+]
InChIInChI=1S/C5H9.CN.Cu.Li/c1-4-5(2)3;1-2;;/h4H,1H2,2-3H3;;;/q2*-1;2*+1
InChIKeySYOYGPNGXNNVNP-UHFFFAOYSA-N
XLogP-1.12
TPSA23.79 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.63
LogP ≤ 5-1.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze lithium;copper(1+);2-methylbut-2-ene;cyanide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

lithium;hydride;2-methylbut-2-ene
CID 174648153
2-methyl-N,N-di(propan-2-yl)prop-1-en-1-amine
CID 4278481
azane;copper(1+);cyanide
CID 23509629
lithium;iron;cyanide
CID 174264357
cobalt(3+);tris(copper(1+));hexacyanide
CID 22460176
lithium;but-1-en-2-yl(trimethyl)germane;copper(1+);cyanide
CID 10468237
alumane;2-methylbut-2-ene
CID 174293100
magnesium;(6E,10E,14E,18E)-2,6,10,14,18-pentamethylicosa-2,6,10,14,18-pentaene;bromide
CID 58409825
2-methylbut-2-ene;silane;hydrate
CID 174815005
cerium;2-methylprop-1-en-1-ol
CID 175572583
1-bromo-2-(113C)methyl(1,3-13C2)prop-1-ene
CID 76973307
3-methylbut-2-enenitrile
CID 178069797

Frequently Asked Questions

What is the IUPAC name of lithium;copper(1+);2-methylbut-2-ene;cyanide?
The IUPAC name of lithium;copper(1+);2-methylbut-2-ene;cyanide (CID 134949546) is lithium;copper(1+);2-methylbut-2-ene;cyanide.
What is the SMILES notation for lithium;copper(1+);2-methylbut-2-ene;cyanide?
The canonical SMILES for lithium;copper(1+);2-methylbut-2-ene;cyanide is [C-]#N.[CH2-]C=C(C)C.[Cu+].[Li+].
What is the InChIKey of lithium;copper(1+);2-methylbut-2-ene;cyanide?
The InChIKey is SYOYGPNGXNNVNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9.CN.Cu.Li/c1-4-5(2)3;1-2;;/h4H,1H2,2-3H3;;;/q2*-1;2*+1.
What are the key properties of lithium;copper(1+);2-methylbut-2-ene;cyanide?
lithium;copper(1+);2-methylbut-2-ene;cyanide has a molecular weight of 165.63 g/mol, XLogP of -1.12, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for lithium;copper(1+);2-methylbut-2-ene;cyanide is sourced from PubChem (CID 134949546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).