potassium 1-[methoxy(methyl)amino]ethenolate

C4H8KNO2 — CID 23680951

IUPACpotassium 1-[methoxy(methyl)amino]ethenolate
SMILESC=C([O-])N(C)OC.[K+]
InChIInChI=1S/C4H9NO2.K/c1-4(6)5(2)7-3;/h6H,1H2,2-3H3;/q;+1/p-1
InChIKeyZNIKMLXNCRLIIM-UHFFFAOYSA-M
MW141.21 g/mol
LogP-3.68
Rot. Bonds2

About potassium 1-[methoxy(methyl)amino]ethenolate

potassium 1-[methoxy(methyl)amino]ethenolate (PubChem CID 23680951) has the molecular formula C4H8KNO2 and a molecular weight of 141.21 g/mol. Its IUPAC name is potassium 1-[methoxy(methyl)amino]ethenolate.

Molecular Properties

Compound Namepotassium 1-[methoxy(methyl)amino]ethenolate
PubChem CID23680951
Molecular FormulaC4H8KNO2
Molecular Weight141.21 g/mol
Exact Mass141.02
IUPAC Namepotassium 1-[methoxy(methyl)amino]ethenolate
SMILESC=C([O-])N(C)OC.[K+]
InChIInChI=1S/C4H9NO2.K/c1-4(6)5(2)7-3;/h6H,1H2,2-3H3;/q;+1/p-1
InChIKeyZNIKMLXNCRLIIM-UHFFFAOYSA-M
XLogP-3.68
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.21
LogP ≤ 5-3.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of potassium 1-[methoxy(methyl)amino]ethenolate?
The IUPAC name of potassium 1-[methoxy(methyl)amino]ethenolate (CID 23680951) is potassium 1-[methoxy(methyl)amino]ethenolate.
What is the SMILES notation for potassium 1-[methoxy(methyl)amino]ethenolate?
The canonical SMILES for potassium 1-[methoxy(methyl)amino]ethenolate is C=C([O-])N(C)OC.[K+].
What is the InChIKey of potassium 1-[methoxy(methyl)amino]ethenolate?
The InChIKey is ZNIKMLXNCRLIIM-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H9NO2.K/c1-4(6)5(2)7-3;/h6H,1H2,2-3H3;/q;+1/p-1.
What are the key properties of potassium 1-[methoxy(methyl)amino]ethenolate?
potassium 1-[methoxy(methyl)amino]ethenolate has a molecular weight of 141.21 g/mol, XLogP of -3.68, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for potassium 1-[methoxy(methyl)amino]ethenolate is sourced from PubChem (CID 23680951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).