2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine

C14H27NO — CID 117271301

IUPAC2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine
SMILESCC(C)C1(CC2CCCOC2)CCCCN1
InChIInChI=1S/C14H27NO/c1-12(2)14(7-3-4-8-15-14)10-13-6-5-9-16-11-13/h12-13,15H,3-11H2,1-2H3
InChIKeyCXGZDIGGLXNXPJ-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds3

About 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine

2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine (PubChem CID 117271301) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine.

Molecular Properties

Compound Name2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine
PubChem CID117271301
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine
SMILESCC(C)C1(CC2CCCOC2)CCCCN1
InChIInChI=1S/C14H27NO/c1-12(2)14(7-3-4-8-15-14)10-13-6-5-9-16-11-13/h12-13,15H,3-11H2,1-2H3
InChIKeyCXGZDIGGLXNXPJ-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine 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

2-(oxolan-3-ylmethyl)-2-propan-2-ylpiperidine
CID 117271154
2-[2-(oxan-3-yl)ethyl]-2-propan-2-ylpiperidine
CID 117271658
2-ethyl-2-propan-2-ylazepane
CID 79117006
2-(2-methylpropyl)-2-propan-2-ylazepane
CID 79119427
1-methyl-3-[2-(2-propan-2-ylpiperidin-2-yl)ethyl]piperidine
CID 117271670
2,5,5-trimethyl-2-(oxan-3-ylmethyl)-1,3-oxazinane
CID 117226653
1-methyl-N-(oxan-3-ylmethyl)cyclopentan-1-amine
CID 63739507
1-(1-methylcyclopropyl)-N-(oxan-3-ylmethyl)ethanamine
CID 61020377
2-propan-2-yl-2-(2-pyrrolidin-2-ylethyl)piperidine
CID 117271627
2-propan-2-yl-2-(thian-2-ylmethyl)pyrrolidine
CID 117271050
2-(3-methoxypropyl)-2-propan-2-ylpiperidine
CID 117271103
3-(2-bromopropyl)oxane
CID 164664099

Frequently Asked Questions

What is the IUPAC name of 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine?
The IUPAC name of 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine (CID 117271301) is 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine.
What is the SMILES notation for 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine?
The canonical SMILES for 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine is CC(C)C1(CC2CCCOC2)CCCCN1.
What is the InChIKey of 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine?
The InChIKey is CXGZDIGGLXNXPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-12(2)14(7-3-4-8-15-14)10-13-6-5-9-16-11-13/h12-13,15H,3-11H2,1-2H3.
What are the key properties of 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine?
2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(oxan-3-ylmethyl)-2-propan-2-ylpiperidine is sourced from PubChem (CID 117271301), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).