3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine

C13H26N2O — CID 115373405

IUPAC3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine
SMILESCCOC1CCN(C2CNCC(C)C2)CC1
InChIInChI=1S/C13H26N2O/c1-3-16-13-4-6-15(7-5-13)12-8-11(2)9-14-10-12/h11-14H,3-10H2,1-2H3
InChIKeyRBMDBEHMZUPQBT-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.49
Rot. Bonds3

About 3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine

3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine (PubChem CID 115373405) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine.

Molecular Properties

Compound Name3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine
PubChem CID115373405
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine
SMILESCCOC1CCN(C2CNCC(C)C2)CC1
InChIInChI=1S/C13H26N2O/c1-3-16-13-4-6-15(7-5-13)12-8-11(2)9-14-10-12/h11-14H,3-10H2,1-2H3
InChIKeyRBMDBEHMZUPQBT-UHFFFAOYSA-N
XLogP1.49
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(5-methylpiperidin-3-yl)-4-propylpiperidine
CID 115373476
3-methyl-5-pyrrolidin-1-ylpiperidine
CID 79905165
3-methoxy-4-methyl-1-(5-methylpiperidin-3-yl)piperidine
CID 102965792
3-(3,4-dimethylpyrrolidin-1-yl)-5-methylpiperidine
CID 115373534
2-(5-methylpiperidin-3-yl)-3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole
CID 115560129
3-ethoxyazetidine
CID 22507733
ethane;1-ethoxy-4-methylcyclohexane
CID 145107105
3-methyl-5-(3-phenylpyrrolidin-1-yl)piperidine
CID 115373475
[1-(4-ethoxypiperidin-1-yl)-3,5-dimethylcyclohexyl]methanamine
CID 64751461
3-[1-(3-methylcyclopentyl)piperidin-4-yl]oxypropan-1-amine
CID 79731758
1-(3-ethoxycyclohexyl)azetidine
CID 163258789
2-methyl-1-(5-methylpiperidin-3-yl)azepane
CID 115373516

Frequently Asked Questions

What is the IUPAC name of 3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine?
The IUPAC name of 3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine (CID 115373405) is 3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine.
What is the SMILES notation for 3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine?
The canonical SMILES for 3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine is CCOC1CCN(C2CNCC(C)C2)CC1.
What is the InChIKey of 3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine?
The InChIKey is RBMDBEHMZUPQBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-3-16-13-4-6-15(7-5-13)12-8-11(2)9-14-10-12/h11-14H,3-10H2,1-2H3.
What are the key properties of 3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine?
3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine has a molecular weight of 226.36 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-ethoxypiperidin-1-yl)-5-methylpiperidine is sourced from PubChem (CID 115373405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).