lithium 4-methanidyl-4-methylpent-1-ene

C7H13Li — CID 134840187

IUPAClithium 4-methanidyl-4-methylpent-1-ene
SMILESC=CCC([CH2-])(C)C.[Li+]
InChIInChI=1S/C7H13.Li/c1-5-6-7(2,3)4;/h5H,1-2,6H2,3-4H3;/q-1;+1
InChIKeyLOKCCWJMVBVWNI-UHFFFAOYSA-N
MW104.12 g/mol
LogP-0.57
Rot. Bonds2

About lithium 4-methanidyl-4-methylpent-1-ene

lithium 4-methanidyl-4-methylpent-1-ene (PubChem CID 134840187) has the molecular formula C7H13Li and a molecular weight of 104.12 g/mol. Its IUPAC name is lithium 4-methanidyl-4-methylpent-1-ene.

Molecular Properties

Compound Namelithium 4-methanidyl-4-methylpent-1-ene
PubChem CID134840187
Molecular FormulaC7H13Li
Molecular Weight104.12 g/mol
Exact Mass104.12
IUPAC Namelithium 4-methanidyl-4-methylpent-1-ene
SMILESC=CCC([CH2-])(C)C.[Li+]
InChIInChI=1S/C7H13.Li/c1-5-6-7(2,3)4;/h5H,1-2,6H2,3-4H3;/q-1;+1
InChIKeyLOKCCWJMVBVWNI-UHFFFAOYSA-N
XLogP-0.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500104.12
LogP ≤ 5-0.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

4-chloro-4-methylpent-1-ene
CID 14174361
(4R,7S)-4,7-dimethyldeca-1,9-diene-4,7-diol
CID 92533073
4-chloro-4-methylpent-1-ene;silane
CID 174547745
4,7-dimethyldeca-1,9-diene-4,7-diamine
CID 10774290
3-methylhexa-1,5-diene-3-thiol
CID 123943954
(3S)-3-methylhexa-1,5-dien-3-ol
CID 11564468
4,5,5,5-tetrafluoro-4-methylpent-1-ene
CID 58901177
3-methylhexa-1,5-dien-3-olate
CID 101095680
3-methanidyl-3-methylbut-1-ene
CID 91253785
4-methyl-4-propylhept-1-ene
CID 139926982
2-methyl-2-prop-2-enylpent-4-en-1-amine;hydrochloride
CID 173037524
2,2-dimethylpent-4-enenitrile;ethane
CID 144998306

Frequently Asked Questions

What is the IUPAC name of lithium 4-methanidyl-4-methylpent-1-ene?
The IUPAC name of lithium 4-methanidyl-4-methylpent-1-ene (CID 134840187) is lithium 4-methanidyl-4-methylpent-1-ene.
What is the SMILES notation for lithium 4-methanidyl-4-methylpent-1-ene?
The canonical SMILES for lithium 4-methanidyl-4-methylpent-1-ene is C=CCC([CH2-])(C)C.[Li+].
What is the InChIKey of lithium 4-methanidyl-4-methylpent-1-ene?
The InChIKey is LOKCCWJMVBVWNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13.Li/c1-5-6-7(2,3)4;/h5H,1-2,6H2,3-4H3;/q-1;+1.
What are the key properties of lithium 4-methanidyl-4-methylpent-1-ene?
lithium 4-methanidyl-4-methylpent-1-ene has a molecular weight of 104.12 g/mol, XLogP of -0.57, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for lithium 4-methanidyl-4-methylpent-1-ene is sourced from PubChem (CID 134840187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).