ethylazanium;tetramethylazanium;dibromide

C6H20Br2N2 — CID 141053148

IUPACethylazanium;tetramethylazanium;dibromide
SMILESCC[NH3+].C[N+](C)(C)C.[Br-].[Br-]
InChIInChI=1S/C4H12N.C2H7N.2BrH/c1-5(2,3)4;1-2-3;;/h1-4H3;2-3H2,1H3;2*1H/q+1;;;/p-1
InChIKeyOEPBWTWYKRRQOF-UHFFFAOYSA-M
MW280.05 g/mol
LogP-6.42
Rot. Bonds

About ethylazanium;tetramethylazanium;dibromide

ethylazanium;tetramethylazanium;dibromide (PubChem CID 141053148) has the molecular formula C6H20Br2N2 and a molecular weight of 280.05 g/mol. Its IUPAC name is ethylazanium;tetramethylazanium;dibromide.

Molecular Properties

Compound Nameethylazanium;tetramethylazanium;dibromide
PubChem CID141053148
Molecular FormulaC6H20Br2N2
Molecular Weight280.05 g/mol
Exact Mass278.00
IUPAC Nameethylazanium;tetramethylazanium;dibromide
SMILESCC[NH3+].C[N+](C)(C)C.[Br-].[Br-]
InChIInChI=1S/C4H12N.C2H7N.2BrH/c1-5(2,3)4;1-2-3;;/h1-4H3;2-3H2,1H3;2*1H/q+1;;;/p-1
InChIKeyOEPBWTWYKRRQOF-UHFFFAOYSA-M
XLogP-6.42
TPSA27.64 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.05
LogP ≤ 5-6.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of ethylazanium;tetramethylazanium;dibromide?
The IUPAC name of ethylazanium;tetramethylazanium;dibromide (CID 141053148) is ethylazanium;tetramethylazanium;dibromide.
What is the SMILES notation for ethylazanium;tetramethylazanium;dibromide?
The canonical SMILES for ethylazanium;tetramethylazanium;dibromide is CC[NH3+].C[N+](C)(C)C.[Br-].[Br-].
What is the InChIKey of ethylazanium;tetramethylazanium;dibromide?
The InChIKey is OEPBWTWYKRRQOF-UHFFFAOYSA-M. The full InChI is InChI=1S/C4H12N.C2H7N.2BrH/c1-5(2,3)4;1-2-3;;/h1-4H3;2-3H2,1H3;2*1H/q+1;;;/p-1.
What are the key properties of ethylazanium;tetramethylazanium;dibromide?
ethylazanium;tetramethylazanium;dibromide has a molecular weight of 280.05 g/mol, XLogP of -6.42, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethylazanium;tetramethylazanium;dibromide is sourced from PubChem (CID 141053148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).