oxolane;tetramethylazanium

C8H20NO+ — CID 86671824

IUPACoxolane;tetramethylazanium
SMILESC1CCOC1.C[N+](C)(C)C
InChIInChI=1S/C4H12N.C4H8O/c1-5(2,3)4;1-2-4-5-3-1/h1-4H3;1-4H2/q+1;
InChIKeyNDWYQENMQSCTNE-UHFFFAOYSA-N
MW146.25 g/mol
LogP1.12
Rot. Bonds

About oxolane;tetramethylazanium

oxolane;tetramethylazanium (PubChem CID 86671824) has the molecular formula C8H20NO+ and a molecular weight of 146.25 g/mol. Its IUPAC name is oxolane;tetramethylazanium.

Molecular Properties

Compound Nameoxolane;tetramethylazanium
PubChem CID86671824
Molecular FormulaC8H20NO+
Molecular Weight146.25 g/mol
Exact Mass146.15
IUPAC Nameoxolane;tetramethylazanium
SMILESC1CCOC1.C[N+](C)(C)C
InChIInChI=1S/C4H12N.C4H8O/c1-5(2,3)4;1-2-4-5-3-1/h1-4H3;1-4H2/q+1;
InChIKeyNDWYQENMQSCTNE-UHFFFAOYSA-N
XLogP1.12
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.25
LogP ≤ 51.12
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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Related Compounds

Butoxymethyl(trimethyl)azanium
CID 3026389
N,N-dimethylmethanamine;oxolane
CID 11457712
Butan-1-olate;tetramethylazanium
CID 20562223
Oxolane;tetraethylazanium;chloride
CID 67914926
Triethylamine tetrahydrofuran
CID 68616177
N,N-dimethylmethanamine;1-ethoxypropane
CID 87853125
potassium;ethane;N-methanidyl-N-methylmethanamine;oxolane
CID 156812899
N,N-dimethylpropan-1-amine;oxolane
CID 156812938
Oxolane;tetramethylazanium;fluoride
CID 157366963
1,4-Diethoxybutane;tetramethylazanium
CID 159107169
Oxolane;trimethyl(propyl)azanium
CID 161281030
N,N-dimethylpropan-1-amine;ethane;oxolane
CID 169251401

Frequently Asked Questions

What is the IUPAC name of oxolane;tetramethylazanium?
The IUPAC name of oxolane;tetramethylazanium (CID 86671824) is oxolane;tetramethylazanium.
What is the SMILES notation for oxolane;tetramethylazanium?
The canonical SMILES for oxolane;tetramethylazanium is C1CCOC1.C[N+](C)(C)C.
What is the InChIKey of oxolane;tetramethylazanium?
The InChIKey is NDWYQENMQSCTNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H12N.C4H8O/c1-5(2,3)4;1-2-4-5-3-1/h1-4H3;1-4H2/q+1;.
What are the key properties of oxolane;tetramethylazanium?
oxolane;tetramethylazanium has a molecular weight of 146.25 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 oxolane;tetramethylazanium is sourced from PubChem (CID 86671824), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).