2-ethoxy-N-(2-ethoxyethyl)ethanamine

C8H19NO2 — CID 547396

IUPAC2-ethoxy-N-(2-ethoxyethyl)ethanamine
SMILESCCOCCNCCOCC
InChIInChI=1S/C8H19NO2/c1-3-10-7-5-9-6-8-11-4-2/h9H,3-8H2,1-2H3
InChIKeyQDZOFZFDBDYWJX-UHFFFAOYSA-N
MW161.25 g/mol
LogP0.65
Rot. Bonds8

About 2-ethoxy-N-(2-ethoxyethyl)ethanamine

2-ethoxy-N-(2-ethoxyethyl)ethanamine (PubChem CID 547396) has the molecular formula C8H19NO2 and a molecular weight of 161.25 g/mol. Its IUPAC name is 2-ethoxy-N-(2-ethoxyethyl)ethanamine.

Molecular Properties

Compound Name2-ethoxy-N-(2-ethoxyethyl)ethanamine
PubChem CID547396
Molecular FormulaC8H19NO2
Molecular Weight161.25 g/mol
Exact Mass161.14
IUPAC Name2-ethoxy-N-(2-ethoxyethyl)ethanamine
SMILESCCOCCNCCOCC
InChIInChI=1S/C8H19NO2/c1-3-10-7-5-9-6-8-11-4-2/h9H,3-8H2,1-2H3
InChIKeyQDZOFZFDBDYWJX-UHFFFAOYSA-N
XLogP0.65
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.25
LogP ≤ 50.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-N-(2-ethoxyethyl)ethanamine?
The IUPAC name of 2-ethoxy-N-(2-ethoxyethyl)ethanamine (CID 547396) is 2-ethoxy-N-(2-ethoxyethyl)ethanamine.
What is the SMILES notation for 2-ethoxy-N-(2-ethoxyethyl)ethanamine?
The canonical SMILES for 2-ethoxy-N-(2-ethoxyethyl)ethanamine is CCOCCNCCOCC.
What is the InChIKey of 2-ethoxy-N-(2-ethoxyethyl)ethanamine?
The InChIKey is QDZOFZFDBDYWJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2/c1-3-10-7-5-9-6-8-11-4-2/h9H,3-8H2,1-2H3.
What are the key properties of 2-ethoxy-N-(2-ethoxyethyl)ethanamine?
2-ethoxy-N-(2-ethoxyethyl)ethanamine has a molecular weight of 161.25 g/mol, XLogP of 0.65, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-N-(2-ethoxyethyl)ethanamine is sourced from PubChem (CID 547396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).