4-(3-propan-2-yloxyazetidin-1-yl)piperidine

C11H22N2O — CID 165137424

IUPAC4-(3-propan-2-yloxyazetidin-1-yl)piperidine
SMILESCC(C)OC1CN(C2CCNCC2)C1
InChIInChI=1S/C11H22N2O/c1-9(2)14-11-7-13(8-11)10-3-5-12-6-4-10/h9-12H,3-8H2,1-2H3
InChIKeyZLCNBFBCYWLWSI-UHFFFAOYSA-N
MW198.31 g/mol
LogP0.85
Rot. Bonds3

About 4-(3-propan-2-yloxyazetidin-1-yl)piperidine

4-(3-propan-2-yloxyazetidin-1-yl)piperidine (PubChem CID 165137424) has the molecular formula C11H22N2O and a molecular weight of 198.31 g/mol. Its IUPAC name is 4-(3-propan-2-yloxyazetidin-1-yl)piperidine.

Molecular Properties

Compound Name4-(3-propan-2-yloxyazetidin-1-yl)piperidine
PubChem CID165137424
Molecular FormulaC11H22N2O
Molecular Weight198.31 g/mol
Exact Mass198.17
IUPAC Name4-(3-propan-2-yloxyazetidin-1-yl)piperidine
SMILESCC(C)OC1CN(C2CCNCC2)C1
InChIInChI=1S/C11H22N2O/c1-9(2)14-11-7-13(8-11)10-3-5-12-6-4-10/h9-12H,3-8H2,1-2H3
InChIKeyZLCNBFBCYWLWSI-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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Frequently Asked Questions

What is the IUPAC name of 4-(3-propan-2-yloxyazetidin-1-yl)piperidine?
The IUPAC name of 4-(3-propan-2-yloxyazetidin-1-yl)piperidine (CID 165137424) is 4-(3-propan-2-yloxyazetidin-1-yl)piperidine.
What is the SMILES notation for 4-(3-propan-2-yloxyazetidin-1-yl)piperidine?
The canonical SMILES for 4-(3-propan-2-yloxyazetidin-1-yl)piperidine is CC(C)OC1CN(C2CCNCC2)C1.
What is the InChIKey of 4-(3-propan-2-yloxyazetidin-1-yl)piperidine?
The InChIKey is ZLCNBFBCYWLWSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O/c1-9(2)14-11-7-13(8-11)10-3-5-12-6-4-10/h9-12H,3-8H2,1-2H3.
What are the key properties of 4-(3-propan-2-yloxyazetidin-1-yl)piperidine?
4-(3-propan-2-yloxyazetidin-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-propan-2-yloxyazetidin-1-yl)piperidine is sourced from PubChem (CID 165137424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).