1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine

C15H28N2O2 — CID 171761936

IUPAC1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine
SMILESCC(C)(C)N1CCC(OC2CN(C3COC3)C2)CC1
InChIInChI=1S/C15H28N2O2/c1-15(2,3)17-6-4-13(5-7-17)19-14-8-16(9-14)12-10-18-11-12/h12-14H,4-11H2,1-3H3
InChIKeyXLHRYNOJSOHOEB-UHFFFAOYSA-N
MW268.40 g/mol
LogP1.35
Rot. Bonds3

About 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine

1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine (PubChem CID 171761936) has the molecular formula C15H28N2O2 and a molecular weight of 268.40 g/mol. Its IUPAC name is 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine.

Molecular Properties

Compound Name1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine
PubChem CID171761936
Molecular FormulaC15H28N2O2
Molecular Weight268.40 g/mol
Exact Mass268.22
IUPAC Name1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine
SMILESCC(C)(C)N1CCC(OC2CN(C3COC3)C2)CC1
InChIInChI=1S/C15H28N2O2/c1-15(2,3)17-6-4-13(5-7-17)19-14-8-16(9-14)12-10-18-11-12/h12-14H,4-11H2,1-3H3
InChIKeyXLHRYNOJSOHOEB-UHFFFAOYSA-N
XLogP1.35
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 51.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-[(2-methylpropan-2-yl)oxy]-1-(oxetan-3-yl)pyrrolidine
CID 149071581
(3S)-3-methoxy-1-(oxetan-3-yl)pyrrolidine
CID 118553663
4-(1-tert-butylpyrrolidin-3-yl)oxypiperidine
CID 117046241
9-tert-butyl-7-(2-tert-butyl-1,3,4,6,7,8,9,9a-octahydropyrido[1,2-a]pyrazin-7-yl)-3-oxa-7,9-diazabicyclo[3.3.1]nonane
CID 146322997
1-tert-butyl-4-(oxolan-3-yl)piperazine
CID 118531588
1-tert-butyl-4-[(2-methylpropan-2-yl)oxy]piperidine
CID 59522786
1-tert-butyl-4-[(1R,3S)-3-[(2-methylpropan-2-yl)oxy]cyclohexyl]oxypiperidine
CID 146549005
1-[(3S)-1-tert-butylpyrrolidin-3-yl]-4-methoxypiperidine
CID 166567506
(3S)-3-(iodomethoxy)-1-(oxetan-3-yl)pyrrolidine
CID 118563690
4-(1-tert-butylpyrrolidin-3-yl)morpholine
CID 58364982
ethane;3-methyl-1-(oxetan-3-yl)azetidine
CID 144739984
1-[(3R)-1-tert-butylpyrrolidin-3-yl]-4-fluoropiperidine
CID 167291830

Frequently Asked Questions

What is the IUPAC name of 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine?
The IUPAC name of 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine (CID 171761936) is 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine.
What is the SMILES notation for 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine?
The canonical SMILES for 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine is CC(C)(C)N1CCC(OC2CN(C3COC3)C2)CC1.
What is the InChIKey of 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine?
The InChIKey is XLHRYNOJSOHOEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O2/c1-15(2,3)17-6-4-13(5-7-17)19-14-8-16(9-14)12-10-18-11-12/h12-14H,4-11H2,1-3H3.
What are the key properties of 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine?
1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine has a molecular weight of 268.40 g/mol, XLogP of 1.35, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-tert-butyl-4-[1-(oxetan-3-yl)azetidin-3-yl]oxypiperidine is sourced from PubChem (CID 171761936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).