4-(3-ethoxy-3-methylazetidin-1-yl)piperidine

C11H22N2O — CID 130804630

IUPAC4-(3-ethoxy-3-methylazetidin-1-yl)piperidine
SMILESCCOC1(C)CN(C2CCNCC2)C1
InChIInChI=1S/C11H22N2O/c1-3-14-11(2)8-13(9-11)10-4-6-12-7-5-10/h10,12H,3-9H2,1-2H3
InChIKeyUCGMENXRLAFUSA-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.85
Rot. Bonds3

About 4-(3-ethoxy-3-methylazetidin-1-yl)piperidine

4-(3-ethoxy-3-methylazetidin-1-yl)piperidine (PubChem CID 130804630) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 4-(3-ethoxy-3-methylazetidin-1-yl)piperidine.

Molecular Properties

Compound Name4-(3-ethoxy-3-methylazetidin-1-yl)piperidine
PubChem CID130804630
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name4-(3-ethoxy-3-methylazetidin-1-yl)piperidine
SMILESCCOC1(C)CN(C2CCNCC2)C1
InChIInChI=1S/C11H22N2O/c1-3-14-11(2)8-13(9-11)10-4-6-12-7-5-10/h10,12H,3-9H2,1-2H3
InChIKeyUCGMENXRLAFUSA-UHFFFAOYSA-N
XLogP0.85
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(3-ethoxy-3-methylazetidin-1-yl)cyclohexan-1-one
CID 130826077
4-[4-(ethoxymethyl)-3,3-dimethylpyrrolidin-1-yl]piperidine
CID 121202793
1-(azepan-4-yl)-3-methylazetidin-3-ol
CID 131182366
(6,6-dimethyl-4-piperidin-4-ylmorpholin-2-yl)methanol
CID 114782622
3-ethoxy-3-methylazetidine
CID 83066072
3-cyclopropyl-1-piperidin-4-ylazetidin-3-ol
CID 130963860
3,3-dimethyl-1-piperidin-4-ylpiperidine;dihydrochloride
CID 156735226
4-methyl-1-piperidin-4-ylpiperidin-4-ol;hydrochloride
CID 75464899
2-[3-methyl-1-(4-methylcyclohexyl)azetidin-3-yl]oxyacetic acid
CID 102659757
1-piperidin-4-yl-4-propylpiperidine
CID 62199816
(3aS,6aR)-5-cyclopropyl-3a,6a-dimethyl-2,3,4,6-tetrahydro-1H-pyrrolo[3,4-c]pyrrole
CID 125453636
2-(3-ethoxy-3-methylazetidin-1-yl)ethanamine
CID 131227820

Frequently Asked Questions

What is the IUPAC name of 4-(3-ethoxy-3-methylazetidin-1-yl)piperidine?
The IUPAC name of 4-(3-ethoxy-3-methylazetidin-1-yl)piperidine (CID 130804630) is 4-(3-ethoxy-3-methylazetidin-1-yl)piperidine.
What is the SMILES notation for 4-(3-ethoxy-3-methylazetidin-1-yl)piperidine?
The canonical SMILES for 4-(3-ethoxy-3-methylazetidin-1-yl)piperidine is CCOC1(C)CN(C2CCNCC2)C1.
What is the InChIKey of 4-(3-ethoxy-3-methylazetidin-1-yl)piperidine?
The InChIKey is UCGMENXRLAFUSA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-3-14-11(2)8-13(9-11)10-4-6-12-7-5-10/h10,12H,3-9H2,1-2H3.
What are the key properties of 4-(3-ethoxy-3-methylazetidin-1-yl)piperidine?
4-(3-ethoxy-3-methylazetidin-1-yl)piperidine has a molecular weight of 198.31 g/mol, XLogP of 0.85, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3-ethoxy-3-methylazetidin-1-yl)piperidine is sourced from PubChem (CID 130804630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).