2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine

C16H35NO6 — CID 130284119

IUPAC2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine
SMILESCCCOCCOCCOCCNCCOCCOCCOC
InChIInChI=1S/C16H35NO6/c1-3-6-19-11-14-23-16-13-21-8-5-17-4-7-20-12-15-22-10-9-18-2/h17H,3-16H2,1-2H3
InChIKeyQKZLRHNVLFYVFI-UHFFFAOYSA-N
MW337.46 g/mol
LogP0.72
Rot. Bonds20

About 2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine

2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine (PubChem CID 130284119) has the molecular formula C16H35NO6 and a molecular weight of 337.46 g/mol. Its IUPAC name is 2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine.

Molecular Properties

Compound Name2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine
PubChem CID130284119
Molecular FormulaC16H35NO6
Molecular Weight337.46 g/mol
Exact Mass337.25
IUPAC Name2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine
SMILESCCCOCCOCCOCCNCCOCCOCCOC
InChIInChI=1S/C16H35NO6/c1-3-6-19-11-14-23-16-13-21-8-5-17-4-7-20-12-15-22-10-9-18-2/h17H,3-16H2,1-2H3
InChIKeyQKZLRHNVLFYVFI-UHFFFAOYSA-N
XLogP0.72
TPSA67.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds20
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.46
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine?
The IUPAC name of 2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine (CID 130284119) is 2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine.
What is the SMILES notation for 2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine?
The canonical SMILES for 2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine is CCCOCCOCCOCCNCCOCCOCCOC.
What is the InChIKey of 2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine?
The InChIKey is QKZLRHNVLFYVFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H35NO6/c1-3-6-19-11-14-23-16-13-21-8-5-17-4-7-20-12-15-22-10-9-18-2/h17H,3-16H2,1-2H3.
What are the key properties of 2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine?
2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine has a molecular weight of 337.46 g/mol, XLogP of 0.72, 20 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxyethoxy)ethoxy]-N-[2-[2-(2-propoxyethoxy)ethoxy]ethyl]ethanamine is sourced from PubChem (CID 130284119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).