2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine

C14H30N2O3 — CID 44592951

IUPAC2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine
SMILESCCOCCOCCOCCNCC1CCNCC1
InChIInChI=1S/C14H30N2O3/c1-2-17-9-10-19-12-11-18-8-7-16-13-14-3-5-15-6-4-14/h14-16H,2-13H2,1H3
InChIKeyNGKMPRZTLAZHPG-UHFFFAOYSA-N
MW274.40 g/mol
LogP0.65
Rot. Bonds12

About 2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine

2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine (PubChem CID 44592951) has the molecular formula C14H30N2O3 and a molecular weight of 274.40 g/mol. Its IUPAC name is 2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine
PubChem CID44592951
Molecular FormulaC14H30N2O3
Molecular Weight274.40 g/mol
Exact Mass274.23
IUPAC Name2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine
SMILESCCOCCOCCOCCNCC1CCNCC1
InChIInChI=1S/C14H30N2O3/c1-2-17-9-10-19-12-11-18-8-7-16-13-14-3-5-15-6-4-14/h14-16H,2-13H2,1H3
InChIKeyNGKMPRZTLAZHPG-UHFFFAOYSA-N
XLogP0.65
TPSA51.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.40
LogP ≤ 50.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine?
The IUPAC name of 2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine (CID 44592951) is 2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine.
What is the SMILES notation for 2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine?
The canonical SMILES for 2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine is CCOCCOCCOCCNCC1CCNCC1.
What is the InChIKey of 2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine?
The InChIKey is NGKMPRZTLAZHPG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O3/c1-2-17-9-10-19-12-11-18-8-7-16-13-14-3-5-15-6-4-14/h14-16H,2-13H2,1H3.
What are the key properties of 2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine?
2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine has a molecular weight of 274.40 g/mol, XLogP of 0.65, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-ethoxyethoxy)ethoxy]-N-(piperidin-4-ylmethyl)ethanamine is sourced from PubChem (CID 44592951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).