azane;methane;trihydrobromide

C3H18Br3N — CID 174458600

IUPACazane;methane;trihydrobromide
SMILESBr.Br.Br.C.C.C.N
InChIInChI=1S/3CH4.3BrH.H3N/h3*1H4;3*1H;1H3
InChIKeyGCEFVZIULOEZKU-UHFFFAOYSA-N
MW307.90 g/mol
LogP3.80
Rot. Bonds

About azane;methane;trihydrobromide

azane;methane;trihydrobromide (PubChem CID 174458600) has the molecular formula C3H18Br3N and a molecular weight of 307.90 g/mol. Its IUPAC name is azane;methane;trihydrobromide.

Molecular Properties

Compound Nameazane;methane;trihydrobromide
PubChem CID174458600
Molecular FormulaC3H18Br3N
Molecular Weight307.90 g/mol
Exact Mass304.90
IUPAC Nameazane;methane;trihydrobromide
SMILESBr.Br.Br.C.C.C.N
InChIInChI=1S/3CH4.3BrH.H3N/h3*1H4;3*1H;1H3
InChIKeyGCEFVZIULOEZKU-UHFFFAOYSA-N
XLogP3.80
TPSA35.00 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.90
LogP ≤ 53.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze azane;methane;trihydrobromide 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 azane;methane;trihydrobromide?
The IUPAC name of azane;methane;trihydrobromide (CID 174458600) is azane;methane;trihydrobromide.
What is the SMILES notation for azane;methane;trihydrobromide?
The canonical SMILES for azane;methane;trihydrobromide is Br.Br.Br.C.C.C.N.
What is the InChIKey of azane;methane;trihydrobromide?
The InChIKey is GCEFVZIULOEZKU-UHFFFAOYSA-N. The full InChI is InChI=1S/3CH4.3BrH.H3N/h3*1H4;3*1H;1H3.
What are the key properties of azane;methane;trihydrobromide?
azane;methane;trihydrobromide has a molecular weight of 307.90 g/mol, XLogP of 3.80, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for azane;methane;trihydrobromide is sourced from PubChem (CID 174458600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).