5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane

C13H26N2O — CID 117227217

IUPAC5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane
SMILESCC1(C)CNC(CCN2CCCCC2)OC1
InChIInChI=1S/C13H26N2O/c1-13(2)10-14-12(16-11-13)6-9-15-7-4-3-5-8-15/h12,14H,3-11H2,1-2H3
InChIKeyULUDDBCRDFFOMG-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.83
Rot. Bonds3

About 5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane

5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane (PubChem CID 117227217) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is 5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane.

Molecular Properties

Compound Name5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane
PubChem CID117227217
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane
SMILESCC1(C)CNC(CCN2CCCCC2)OC1
InChIInChI=1S/C13H26N2O/c1-13(2)10-14-12(16-11-13)6-9-15-7-4-3-5-8-15/h12,14H,3-11H2,1-2H3
InChIKeyULUDDBCRDFFOMG-UHFFFAOYSA-N
XLogP1.83
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 ≤ 51.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5,5-dimethyl-2-[2-(4-methylpiperazin-1-yl)ethyl]-1,3-oxazinane;hydrochloride
CID 117227196
4,4-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazolidine
CID 117228610
2-(2-pyrrolidin-1-ylethyl)-1,3-oxazolidine
CID 117225837
5,5-dimethyl-2-[(1-propan-2-ylpiperidin-4-yl)methyl]-1,3-oxazinane
CID 117226361
4-methyl-2-(2-pyrrolidin-1-ylethyl)-1,3-oxazolidine;hydrochloride
CID 117228597
5,5-dimethyl-2-[(1-propan-2-ylpyrrolidin-3-yl)methyl]-1,3-oxazinane;hydrochloride
CID 117226304
5,5-dimethyl-2-(oxolan-3-ylmethyl)-1,3-oxazinane
CID 117226259
2,4,4-trimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazolidine
CID 117228618
2-(1-ethylpiperidin-4-yl)-5,5-dimethyl-1,3-oxazinane;hydrochloride
CID 117226246
2-cyclohexyl-5,5-dimethyl-1,3-oxazinane;hydrochloride
CID 117227188
5,5-dimethyl-2-(pyrrolidin-1-ylmethyl)piperidine
CID 15165793
1-[2-(3-methylpyrrolidin-2-yl)ethyl]piperidine
CID 5042776

Frequently Asked Questions

What is the IUPAC name of 5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane?
The IUPAC name of 5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane (CID 117227217) is 5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane.
What is the SMILES notation for 5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane?
The canonical SMILES for 5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane is CC1(C)CNC(CCN2CCCCC2)OC1.
What is the InChIKey of 5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane?
The InChIKey is ULUDDBCRDFFOMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-13(2)10-14-12(16-11-13)6-9-15-7-4-3-5-8-15/h12,14H,3-11H2,1-2H3.
What are the key properties of 5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane?
5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane has a molecular weight of 226.36 g/mol, XLogP of 1.83, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane is sourced from PubChem (CID 117227217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).