methanol;trimethylazanium;hydroxide

C4H15NO2 — CID 21313545

IUPACmethanol;trimethylazanium;hydroxide
SMILESCO.C[NH+](C)C.[OH-]
InChIInChI=1S/C3H9N.CH4O.H2O/c1-4(2)3;1-2;/h1-3H3;2H,1H3;1H2
InChIKeyJWUQTBNFAXXJJF-UHFFFAOYSA-N
MW109.17 g/mol
LogP-1.81
Rot. Bonds

About methanol;trimethylazanium;hydroxide

methanol;trimethylazanium;hydroxide (PubChem CID 21313545) has the molecular formula C4H15NO2 and a molecular weight of 109.17 g/mol. Its IUPAC name is methanol;trimethylazanium;hydroxide.

Molecular Properties

Compound Namemethanol;trimethylazanium;hydroxide
PubChem CID21313545
Molecular FormulaC4H15NO2
Molecular Weight109.17 g/mol
Exact Mass109.11
IUPAC Namemethanol;trimethylazanium;hydroxide
SMILESCO.C[NH+](C)C.[OH-]
InChIInChI=1S/C3H9N.CH4O.H2O/c1-4(2)3;1-2;/h1-3H3;2H,1H3;1H2
InChIKeyJWUQTBNFAXXJJF-UHFFFAOYSA-N
XLogP-1.81
TPSA54.67 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500109.17
LogP ≤ 5-1.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of methanol;trimethylazanium;hydroxide?
The IUPAC name of methanol;trimethylazanium;hydroxide (CID 21313545) is methanol;trimethylazanium;hydroxide.
What is the SMILES notation for methanol;trimethylazanium;hydroxide?
The canonical SMILES for methanol;trimethylazanium;hydroxide is CO.C[NH+](C)C.[OH-].
What is the InChIKey of methanol;trimethylazanium;hydroxide?
The InChIKey is JWUQTBNFAXXJJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.CH4O.H2O/c1-4(2)3;1-2;/h1-3H3;2H,1H3;1H2.
What are the key properties of methanol;trimethylazanium;hydroxide?
methanol;trimethylazanium;hydroxide has a molecular weight of 109.17 g/mol, XLogP of -1.81, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;trimethylazanium;hydroxide is sourced from PubChem (CID 21313545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).