ethyl(methyl)azanium chloride

C3H10ClN — CID 12218

IUPACethyl(methyl)azanium chloride
SMILESCC[NH2+]C.[Cl-]
InChIInChI=1S/C3H9N.ClH/c1-3-4-2;/h4H,3H2,1-2H3;1H
InChIKeyGEHLEADVHVVTET-UHFFFAOYSA-N
MW95.57 g/mol
LogP-3.80
Rot. Bonds1

About ethyl(methyl)azanium chloride

ethyl(methyl)azanium chloride (PubChem CID 12218) has the molecular formula C3H10ClN and a molecular weight of 95.57 g/mol. Its IUPAC name is ethyl(methyl)azanium chloride.

Molecular Properties

Compound Nameethyl(methyl)azanium chloride
PubChem CID12218
Molecular FormulaC3H10ClN
Molecular Weight95.57 g/mol
Exact Mass95.05
IUPAC Nameethyl(methyl)azanium chloride
SMILESCC[NH2+]C.[Cl-]
InChIInChI=1S/C3H9N.ClH/c1-3-4-2;/h4H,3H2,1-2H3;1H
InChIKeyGEHLEADVHVVTET-UHFFFAOYSA-N
XLogP-3.80
TPSA16.61 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50095.57
LogP ≤ 5-3.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Related Compounds

Diethylamine
CID 8021
Diethylammonium chloride
CID 10197650
N-Methylethylamine
CID 12219
Ethylamine hydrochloride
CID 11198
Diethylamine, hydrochloride
CID 12618
Ethanamine, N-methyl-, hydrochloride (1:1)
CID 522048
Diethylammonium
CID 3793118
Diethylamine N-d1
CID 136781
N-Ethylethan(~15~N)amine--hydrogen chloride (1/1)
CID 16213412
Ethylazanium chloride
CID 521681
Diethyl-d10-amine
CID 13000365
(~2~H_5_)Ethanamine--hydrogen chloride (1/1)
CID 16213297

Frequently Asked Questions

What is the IUPAC name of ethyl(methyl)azanium chloride?
The IUPAC name of ethyl(methyl)azanium chloride (CID 12218) is ethyl(methyl)azanium chloride.
What is the SMILES notation for ethyl(methyl)azanium chloride?
The canonical SMILES for ethyl(methyl)azanium chloride is CC[NH2+]C.[Cl-].
What is the InChIKey of ethyl(methyl)azanium chloride?
The InChIKey is GEHLEADVHVVTET-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N.ClH/c1-3-4-2;/h4H,3H2,1-2H3;1H.
What are the key properties of ethyl(methyl)azanium chloride?
ethyl(methyl)azanium chloride has a molecular weight of 95.57 g/mol, XLogP of -3.80, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl(methyl)azanium chloride is sourced from PubChem (CID 12218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).