1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine

C20H40N2O4 — CID 44592887

IUPAC1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine
SMILESCCOCCOCCOCCOCCN1CCC(C2CCNCC2)CC1
InChIInChI=1S/C20H40N2O4/c1-2-23-13-14-25-17-18-26-16-15-24-12-11-22-9-5-20(6-10-22)19-3-7-21-8-4-19/h19-21H,2-18H2,1H3
InChIKeyFXLHQLFQTOGYFF-UHFFFAOYSA-N
MW372.55 g/mol
LogP1.78
Rot. Bonds14

About 1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine

1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine (PubChem CID 44592887) has the molecular formula C20H40N2O4 and a molecular weight of 372.55 g/mol. Its IUPAC name is 1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine.

Molecular Properties

Compound Name1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine
PubChem CID44592887
Molecular FormulaC20H40N2O4
Molecular Weight372.55 g/mol
Exact Mass372.30
IUPAC Name1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine
SMILESCCOCCOCCOCCOCCN1CCC(C2CCNCC2)CC1
InChIInChI=1S/C20H40N2O4/c1-2-23-13-14-25-17-18-26-16-15-24-12-11-22-9-5-20(6-10-22)19-3-7-21-8-4-19/h19-21H,2-18H2,1H3
InChIKeyFXLHQLFQTOGYFF-UHFFFAOYSA-N
XLogP1.78
TPSA52.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds14
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.55
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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 1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine?
The IUPAC name of 1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine (CID 44592887) is 1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine.
What is the SMILES notation for 1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine?
The canonical SMILES for 1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine is CCOCCOCCOCCOCCN1CCC(C2CCNCC2)CC1.
What is the InChIKey of 1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine?
The InChIKey is FXLHQLFQTOGYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H40N2O4/c1-2-23-13-14-25-17-18-26-16-15-24-12-11-22-9-5-20(6-10-22)19-3-7-21-8-4-19/h19-21H,2-18H2,1H3.
What are the key properties of 1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine?
1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine has a molecular weight of 372.55 g/mol, XLogP of 1.78, 14 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[2-[2-(2-ethoxyethoxy)ethoxy]ethoxy]ethyl]-4-piperidin-4-ylpiperidine is sourced from PubChem (CID 44592887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).