3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine

C15H30N2O — CID 55167023

IUPAC3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine
SMILESCCOC1CCCN(CC2(CC)CCCNC2)C1
InChIInChI=1S/C15H30N2O/c1-3-15(8-6-9-16-12-15)13-17-10-5-7-14(11-17)18-4-2/h14,16H,3-13H2,1-2H3
InChIKeyOAYWLGKGQIDNEE-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.27
Rot. Bonds5

About 3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine

3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine (PubChem CID 55167023) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is 3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine.

Molecular Properties

Compound Name3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine
PubChem CID55167023
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC Name3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine
SMILESCCOC1CCCN(CC2(CC)CCCNC2)C1
InChIInChI=1S/C15H30N2O/c1-3-15(8-6-9-16-12-15)13-17-10-5-7-14(11-17)18-4-2/h14,16H,3-13H2,1-2H3
InChIKeyOAYWLGKGQIDNEE-UHFFFAOYSA-N
XLogP2.27
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine?
The IUPAC name of 3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine (CID 55167023) is 3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine.
What is the SMILES notation for 3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine?
The canonical SMILES for 3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine is CCOC1CCCN(CC2(CC)CCCNC2)C1.
What is the InChIKey of 3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine?
The InChIKey is OAYWLGKGQIDNEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-3-15(8-6-9-16-12-15)13-17-10-5-7-14(11-17)18-4-2/h14,16H,3-13H2,1-2H3.
What are the key properties of 3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine?
3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine has a molecular weight of 254.42 g/mol, XLogP of 2.27, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-1-[(3-ethylpiperidin-3-yl)methyl]piperidine is sourced from PubChem (CID 55167023), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).