1-ethoxy-N-(1-ethoxyethyl)ethanamine

C8H19NO2 — CID 18629767

IUPAC1-ethoxy-N-(1-ethoxyethyl)ethanamine
SMILESCCOC(C)NC(C)OCC
InChIInChI=1S/C8H19NO2/c1-5-10-7(3)9-8(4)11-6-2/h7-9H,5-6H2,1-4H3
InChIKeyQMNPFNWBUBAOFK-UHFFFAOYSA-N
MW161.24 g/mol
LogP1.34
Rot. Bonds6

About 1-ethoxy-N-(1-ethoxyethyl)ethanamine

1-ethoxy-N-(1-ethoxyethyl)ethanamine (PubChem CID 18629767) has the molecular formula C8H19NO2 and a molecular weight of 161.24 g/mol. Its IUPAC name is 1-ethoxy-N-(1-ethoxyethyl)ethanamine.

Molecular Properties

Compound Name1-ethoxy-N-(1-ethoxyethyl)ethanamine
PubChem CID18629767
Molecular FormulaC8H19NO2
Molecular Weight161.24 g/mol
Exact Mass161.14
IUPAC Name1-ethoxy-N-(1-ethoxyethyl)ethanamine
SMILESCCOC(C)NC(C)OCC
InChIInChI=1S/C8H19NO2/c1-5-10-7(3)9-8(4)11-6-2/h7-9H,5-6H2,1-4H3
InChIKeyQMNPFNWBUBAOFK-UHFFFAOYSA-N
XLogP1.34
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.24
LogP ≤ 51.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-N-(1-ethoxyethyl)ethanamine?
The IUPAC name of 1-ethoxy-N-(1-ethoxyethyl)ethanamine (CID 18629767) is 1-ethoxy-N-(1-ethoxyethyl)ethanamine.
What is the SMILES notation for 1-ethoxy-N-(1-ethoxyethyl)ethanamine?
The canonical SMILES for 1-ethoxy-N-(1-ethoxyethyl)ethanamine is CCOC(C)NC(C)OCC.
What is the InChIKey of 1-ethoxy-N-(1-ethoxyethyl)ethanamine?
The InChIKey is QMNPFNWBUBAOFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H19NO2/c1-5-10-7(3)9-8(4)11-6-2/h7-9H,5-6H2,1-4H3.
What are the key properties of 1-ethoxy-N-(1-ethoxyethyl)ethanamine?
1-ethoxy-N-(1-ethoxyethyl)ethanamine has a molecular weight of 161.24 g/mol, XLogP of 1.34, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-N-(1-ethoxyethyl)ethanamine is sourced from PubChem (CID 18629767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).