dimethylazanium chloride

C2H8ClN — CID 521289

IUPACdimethylazanium chloride
SMILESC[NH2+]C.[Cl-]
InChIInChI=1S/C2H7N.ClH/c1-3-2;/h3H,1-2H3;1H
InChIKeyIQDGSYLLQPDQDV-UHFFFAOYSA-N
MW81.55 g/mol
LogP-4.19
Rot. Bonds

About dimethylazanium chloride

dimethylazanium chloride (PubChem CID 521289) has the molecular formula C2H8ClN and a molecular weight of 81.55 g/mol. Its IUPAC name is dimethylazanium chloride.

Molecular Properties

Compound Namedimethylazanium chloride
PubChem CID521289
Molecular FormulaC2H8ClN
Molecular Weight81.55 g/mol
Exact Mass81.03
IUPAC Namedimethylazanium chloride
SMILESC[NH2+]C.[Cl-]
InChIInChI=1S/C2H7N.ClH/c1-3-2;/h3H,1-2H3;1H
InChIKeyIQDGSYLLQPDQDV-UHFFFAOYSA-N
XLogP-4.19
TPSA16.61 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms4
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50081.55
LogP ≤ 5-4.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of dimethylazanium chloride?
The IUPAC name of dimethylazanium chloride (CID 521289) is dimethylazanium chloride.
What is the SMILES notation for dimethylazanium chloride?
The canonical SMILES for dimethylazanium chloride is C[NH2+]C.[Cl-].
What is the InChIKey of dimethylazanium chloride?
The InChIKey is IQDGSYLLQPDQDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H7N.ClH/c1-3-2;/h3H,1-2H3;1H.
What are the key properties of dimethylazanium chloride?
dimethylazanium chloride has a molecular weight of 81.55 g/mol, XLogP of -4.19, 0 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for dimethylazanium chloride is sourced from PubChem (CID 521289), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).