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

C13H27ClN2O — CID 117227212

IUPAC2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride
SMILESCC1CNC(C)(CCN2CCCCC2)OC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-12-10-14-13(2,16-11-12)6-9-15-7-4-3-5-8-15;/h12,14H,3-11H2,1-2H3;1H
InChIKeyBYNPIMOKZCPVPK-UHFFFAOYSA-N
MW262.82 g/mol
LogP2.26
Rot. Bonds3

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

2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride (PubChem CID 117227212) has the molecular formula C13H27ClN2O and a molecular weight of 262.82 g/mol. Its IUPAC name is 2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride.

Molecular Properties

Compound Name2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride
PubChem CID117227212
Molecular FormulaC13H27ClN2O
Molecular Weight262.82 g/mol
Exact Mass262.18
IUPAC Name2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride
SMILESCC1CNC(C)(CCN2CCCCC2)OC1.Cl
InChIInChI=1S/C13H26N2O.ClH/c1-12-10-14-13(2,16-11-12)6-9-15-7-4-3-5-8-15;/h12,14H,3-11H2,1-2H3;1H
InChIKeyBYNPIMOKZCPVPK-UHFFFAOYSA-N
XLogP2.26
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.82
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride?
The IUPAC name of 2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride (CID 117227212) is 2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride.
What is the SMILES notation for 2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride?
The canonical SMILES for 2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride is CC1CNC(C)(CCN2CCCCC2)OC1.Cl.
What is the InChIKey of 2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride?
The InChIKey is BYNPIMOKZCPVPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O.ClH/c1-12-10-14-13(2,16-11-12)6-9-15-7-4-3-5-8-15;/h12,14H,3-11H2,1-2H3;1H.
What are the key properties of 2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride?
2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride has a molecular weight of 262.82 g/mol, XLogP of 2.26, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-2-(2-piperidin-1-ylethyl)-1,3-oxazinane;hydrochloride is sourced from PubChem (CID 117227212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).