trimethylazanium bromide

C3H10BrN — CID 14544808

IUPACtrimethylazanium bromide
SMILESC[NH+](C)C.[Br-]
InChIInChI=1S/C3H9N.BrH/c1-4(2)3;/h1-3H3;1H
InChIKeyAISMNBXOJRHCIA-UHFFFAOYSA-N
MW140.02 g/mol
LogP-4.24
Rot. Bonds

About trimethylazanium bromide

trimethylazanium bromide (PubChem CID 14544808) has the molecular formula C3H10BrN and a molecular weight of 140.02 g/mol. Its IUPAC name is trimethylazanium bromide.

Molecular Properties

Compound Nametrimethylazanium bromide
PubChem CID14544808
Molecular FormulaC3H10BrN
Molecular Weight140.02 g/mol
Exact Mass139.00
IUPAC Nametrimethylazanium bromide
SMILESC[NH+](C)C.[Br-]
InChIInChI=1S/C3H9N.BrH/c1-4(2)3;/h1-3H3;1H
InChIKeyAISMNBXOJRHCIA-UHFFFAOYSA-N
XLogP-4.24
TPSA4.44 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.02
LogP ≤ 5-4.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Analyze trimethylazanium bromide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of trimethylazanium bromide?
The IUPAC name of trimethylazanium bromide (CID 14544808) is trimethylazanium bromide.
What is the SMILES notation for trimethylazanium bromide?
The canonical SMILES for trimethylazanium bromide is C[NH+](C)C.[Br-].
What is the InChIKey of trimethylazanium bromide?
The InChIKey is AISMNBXOJRHCIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.BrH/c1-4(2)3;/h1-3H3;1H.
What are the key properties of trimethylazanium bromide?
trimethylazanium bromide has a molecular weight of 140.02 g/mol, XLogP of -4.24, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for trimethylazanium bromide is sourced from PubChem (CID 14544808), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).