bis(trimethylazanium) diiodide

C6H20I2N2 — CID 119097552

IUPACbis(trimethylazanium) diiodide
SMILESC[NH+](C)C.C[NH+](C)C.[I-].[I-]
InChIInChI=1S/2C3H9N.2HI/c2*1-4(2)3;;/h2*1-3H3;2*1H
InChIKeyNPRDKIVYUMSOAS-UHFFFAOYSA-N
MW374.05 g/mol
LogP-8.47
Rot. Bonds

About bis(trimethylazanium) diiodide

bis(trimethylazanium) diiodide (PubChem CID 119097552) has the molecular formula C6H20I2N2 and a molecular weight of 374.05 g/mol. Its IUPAC name is bis(trimethylazanium) diiodide.

Molecular Properties

Compound Namebis(trimethylazanium) diiodide
PubChem CID119097552
Molecular FormulaC6H20I2N2
Molecular Weight374.05 g/mol
Exact Mass373.97
IUPAC Namebis(trimethylazanium) diiodide
SMILESC[NH+](C)C.C[NH+](C)C.[I-].[I-]
InChIInChI=1S/2C3H9N.2HI/c2*1-4(2)3;;/h2*1-3H3;2*1H
InChIKeyNPRDKIVYUMSOAS-UHFFFAOYSA-N
XLogP-8.47
TPSA8.88 Ų
H-Bond Donors2
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.05
LogP ≤ 5-8.47
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(trimethylazanium) diiodide?
The IUPAC name of bis(trimethylazanium) diiodide (CID 119097552) is bis(trimethylazanium) diiodide.
What is the SMILES notation for bis(trimethylazanium) diiodide?
The canonical SMILES for bis(trimethylazanium) diiodide is C[NH+](C)C.C[NH+](C)C.[I-].[I-].
What is the InChIKey of bis(trimethylazanium) diiodide?
The InChIKey is NPRDKIVYUMSOAS-UHFFFAOYSA-N. The full InChI is InChI=1S/2C3H9N.2HI/c2*1-4(2)3;;/h2*1-3H3;2*1H.
What are the key properties of bis(trimethylazanium) diiodide?
bis(trimethylazanium) diiodide has a molecular weight of 374.05 g/mol, XLogP of -8.47, 0 rotatable bonds, 2 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for bis(trimethylazanium) diiodide is sourced from PubChem (CID 119097552), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).