methanolate;tetramethylazanium

C5H15NO — CID 10964429

IUPACmethanolate;tetramethylazanium
SMILESC[N+](C)(C)C.C[O-]
InChIInChI=1S/C4H12N.CH3O/c1-5(2,3)4;1-2/h1-4H3;1H3/q+1;-1
InChIKeyYYKSEPZQBYEGIW-UHFFFAOYSA-N
MW105.18 g/mol
LogP-0.70
Rot. Bonds

About methanolate;tetramethylazanium

methanolate;tetramethylazanium (PubChem CID 10964429) has the molecular formula C5H15NO and a molecular weight of 105.18 g/mol. Its IUPAC name is methanolate;tetramethylazanium.

Molecular Properties

Compound Namemethanolate;tetramethylazanium
PubChem CID10964429
Molecular FormulaC5H15NO
Molecular Weight105.18 g/mol
Exact Mass105.12
IUPAC Namemethanolate;tetramethylazanium
SMILESC[N+](C)(C)C.C[O-]
InChIInChI=1S/C4H12N.CH3O/c1-5(2,3)4;1-2/h1-4H3;1H3/q+1;-1
InChIKeyYYKSEPZQBYEGIW-UHFFFAOYSA-N
XLogP-0.70
TPSA23.06 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500105.18
LogP ≤ 5-0.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of methanolate;tetramethylazanium?
The IUPAC name of methanolate;tetramethylazanium (CID 10964429) is methanolate;tetramethylazanium.
What is the SMILES notation for methanolate;tetramethylazanium?
The canonical SMILES for methanolate;tetramethylazanium is C[N+](C)(C)C.C[O-].
What is the InChIKey of methanolate;tetramethylazanium?
The InChIKey is YYKSEPZQBYEGIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N.CH3O/c1-5(2,3)4;1-2/h1-4H3;1H3/q+1;-1.
What are the key properties of methanolate;tetramethylazanium?
methanolate;tetramethylazanium has a molecular weight of 105.18 g/mol, XLogP of -0.70, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for methanolate;tetramethylazanium is sourced from PubChem (CID 10964429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).