azanium;trimethylazanium;dihydroxide

C3H16N2O2 — CID 160731109

IUPACazanium;trimethylazanium;dihydroxide
SMILESC[NH+](C)C.[NH4+].[OH-].[OH-]
InChIInChI=1S/C3H9N.H3N.2H2O/c1-4(2)3;;;/h1-3H3;1H3;2*1H2
InChIKeyRUIUHPQZHXVANK-UHFFFAOYSA-N
MW112.17 g/mol
LogP-1.22
Rot. Bonds

About azanium;trimethylazanium;dihydroxide

azanium;trimethylazanium;dihydroxide (PubChem CID 160731109) has the molecular formula C3H16N2O2 and a molecular weight of 112.17 g/mol. Its IUPAC name is azanium;trimethylazanium;dihydroxide.

Molecular Properties

Compound Nameazanium;trimethylazanium;dihydroxide
PubChem CID160731109
Molecular FormulaC3H16N2O2
Molecular Weight112.17 g/mol
Exact Mass112.12
IUPAC Nameazanium;trimethylazanium;dihydroxide
SMILESC[NH+](C)C.[NH4+].[OH-].[OH-]
InChIInChI=1S/C3H9N.H3N.2H2O/c1-4(2)3;;;/h1-3H3;1H3;2*1H2
InChIKeyRUIUHPQZHXVANK-UHFFFAOYSA-N
XLogP-1.22
TPSA100.94 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500112.17
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of azanium;trimethylazanium;dihydroxide?
The IUPAC name of azanium;trimethylazanium;dihydroxide (CID 160731109) is azanium;trimethylazanium;dihydroxide.
What is the SMILES notation for azanium;trimethylazanium;dihydroxide?
The canonical SMILES for azanium;trimethylazanium;dihydroxide is C[NH+](C)C.[NH4+].[OH-].[OH-].
What is the InChIKey of azanium;trimethylazanium;dihydroxide?
The InChIKey is RUIUHPQZHXVANK-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.H3N.2H2O/c1-4(2)3;;;/h1-3H3;1H3;2*1H2.
What are the key properties of azanium;trimethylazanium;dihydroxide?
azanium;trimethylazanium;dihydroxide has a molecular weight of 112.17 g/mol, XLogP of -1.22, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for azanium;trimethylazanium;dihydroxide is sourced from PubChem (CID 160731109), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).