2-aminoethylazanium chloride

C2H9ClN2 — CID 27300

IUPAC2-aminoethylazanium chloride
SMILESNCC[NH3+].[Cl-]
InChIInChI=1S/C2H8N2.ClH/c3-1-2-4;/h1-4H2;1H
InChIKeyHCFPRFJJTHMING-UHFFFAOYSA-N
MW96.56 g/mol
LogP-4.81
Rot. Bonds1

About 2-aminoethylazanium chloride

2-aminoethylazanium chloride (PubChem CID 27300) has the molecular formula C2H9ClN2 and a molecular weight of 96.56 g/mol. Its IUPAC name is 2-aminoethylazanium chloride.

Molecular Properties

Compound Name2-aminoethylazanium chloride
PubChem CID27300
Molecular FormulaC2H9ClN2
Molecular Weight96.56 g/mol
Exact Mass96.05
IUPAC Name2-aminoethylazanium chloride
SMILESNCC[NH3+].[Cl-]
InChIInChI=1S/C2H8N2.ClH/c3-1-2-4;/h1-4H2;1H
InChIKeyHCFPRFJJTHMING-UHFFFAOYSA-N
XLogP-4.81
TPSA53.66 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms5
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50096.56
LogP ≤ 5-4.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-aminoethylazanium chloride?
The IUPAC name of 2-aminoethylazanium chloride (CID 27300) is 2-aminoethylazanium chloride.
What is the SMILES notation for 2-aminoethylazanium chloride?
The canonical SMILES for 2-aminoethylazanium chloride is NCC[NH3+].[Cl-].
What is the InChIKey of 2-aminoethylazanium chloride?
The InChIKey is HCFPRFJJTHMING-UHFFFAOYSA-N. The full InChI is InChI=1S/C2H8N2.ClH/c3-1-2-4;/h1-4H2;1H.
What are the key properties of 2-aminoethylazanium chloride?
2-aminoethylazanium chloride has a molecular weight of 96.56 g/mol, XLogP of -4.81, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminoethylazanium chloride is sourced from PubChem (CID 27300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).