potassium N-ethenyl-2-methylpropan-1-imine

C6H9KN- — CID 59819865

IUPACpotassium N-ethenyl-2-methylpropan-1-imine
SMILES[H]/[C-]=C/N=[C-]/C(C)C.[K+]
InChIInChI=1S/C6H9N.K/c1-4-7-5-6(2)3;/h1,4,6H,2-3H3;/q-2;+1
InChIKeyPIVDXPGOTDNOLM-UHFFFAOYSA-N
MW134.24 g/mol
LogP-1.46
Rot. Bonds2

About potassium N-ethenyl-2-methylpropan-1-imine

potassium N-ethenyl-2-methylpropan-1-imine (PubChem CID 59819865) has the molecular formula C6H9KN- and a molecular weight of 134.24 g/mol. Its IUPAC name is potassium N-ethenyl-2-methylpropan-1-imine.

Molecular Properties

Compound Namepotassium N-ethenyl-2-methylpropan-1-imine
PubChem CID59819865
Molecular FormulaC6H9KN-
Molecular Weight134.24 g/mol
Exact Mass134.04
IUPAC Namepotassium N-ethenyl-2-methylpropan-1-imine
SMILES[H]/[C-]=C/N=[C-]/C(C)C.[K+]
InChIInChI=1S/C6H9N.K/c1-4-7-5-6(2)3;/h1,4,6H,2-3H3;/q-2;+1
InChIKeyPIVDXPGOTDNOLM-UHFFFAOYSA-N
XLogP-1.46
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.24
LogP ≤ 5-1.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of potassium N-ethenyl-2-methylpropan-1-imine?
The IUPAC name of potassium N-ethenyl-2-methylpropan-1-imine (CID 59819865) is potassium N-ethenyl-2-methylpropan-1-imine.
What is the SMILES notation for potassium N-ethenyl-2-methylpropan-1-imine?
The canonical SMILES for potassium N-ethenyl-2-methylpropan-1-imine is [H]/[C-]=C/N=[C-]/C(C)C.[K+].
What is the InChIKey of potassium N-ethenyl-2-methylpropan-1-imine?
The InChIKey is PIVDXPGOTDNOLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N.K/c1-4-7-5-6(2)3;/h1,4,6H,2-3H3;/q-2;+1.
What are the key properties of potassium N-ethenyl-2-methylpropan-1-imine?
potassium N-ethenyl-2-methylpropan-1-imine has a molecular weight of 134.24 g/mol, XLogP of -1.46, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium N-ethenyl-2-methylpropan-1-imine is sourced from PubChem (CID 59819865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).