2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine

C11H24N2O2 — CID 79707310

IUPAC2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine
SMILESCOCCOCCNCC1CCNCC1
InChIInChI=1S/C11H24N2O2/c1-14-8-9-15-7-6-13-10-11-2-4-12-5-3-11/h11-13H,2-10H2,1H3
InChIKeyQTOVYSOHYGQZKL-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.24
Rot. Bonds8

About 2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine

2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine (PubChem CID 79707310) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine.

Molecular Properties

Compound Name2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine
PubChem CID79707310
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine
SMILESCOCCOCCNCC1CCNCC1
InChIInChI=1S/C11H24N2O2/c1-14-8-9-15-7-6-13-10-11-2-4-12-5-3-11/h11-13H,2-10H2,1H3
InChIKeyQTOVYSOHYGQZKL-UHFFFAOYSA-N
XLogP0.24
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine?
The IUPAC name of 2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine (CID 79707310) is 2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine.
What is the SMILES notation for 2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine?
The canonical SMILES for 2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine is COCCOCCNCC1CCNCC1.
What is the InChIKey of 2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine?
The InChIKey is QTOVYSOHYGQZKL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-14-8-9-15-7-6-13-10-11-2-4-12-5-3-11/h11-13H,2-10H2,1H3.
What are the key properties of 2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine?
2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine has a molecular weight of 216.32 g/mol, XLogP of 0.24, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethoxy)-N-(piperidin-4-ylmethyl)ethanamine is sourced from PubChem (CID 79707310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).