2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol

C12H23NO2 — CID 22323165

IUPAC2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol
SMILESCC1(C)CC(O)CC(C)(C)N1CC1CO1
InChIInChI=1S/C12H23NO2/c1-11(2)5-9(14)6-12(3,4)13(11)7-10-8-15-10/h9-10,14H,5-8H2,1-4H3
InChIKeyGOWWQRAEWBATLK-UHFFFAOYSA-N
MW213.32 g/mol
LogP1.40
Rot. Bonds2

About 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol

2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol (PubChem CID 22323165) has the molecular formula C12H23NO2 and a molecular weight of 213.32 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol
PubChem CID22323165
Molecular FormulaC12H23NO2
Molecular Weight213.32 g/mol
Exact Mass213.17
IUPAC Name2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol
SMILESCC1(C)CC(O)CC(C)(C)N1CC1CO1
InChIInChI=1S/C12H23NO2/c1-11(2)5-9(14)6-12(3,4)13(11)7-10-8-15-10/h9-10,14H,5-8H2,1-4H3
InChIKeyGOWWQRAEWBATLK-UHFFFAOYSA-N
XLogP1.40
TPSA36.00 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.32
LogP ≤ 51.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Three-membered_heterocycle', 'substructure': 'N/A'}

Analyze 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol 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 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol?
The IUPAC name of 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol (CID 22323165) is 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol.
What is the SMILES notation for 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol?
The canonical SMILES for 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol is CC1(C)CC(O)CC(C)(C)N1CC1CO1.
What is the InChIKey of 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol?
The InChIKey is GOWWQRAEWBATLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO2/c1-11(2)5-9(14)6-12(3,4)13(11)7-10-8-15-10/h9-10,14H,5-8H2,1-4H3.
What are the key properties of 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol?
2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol has a molecular weight of 213.32 g/mol, XLogP of 1.40, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-1-(oxiran-2-ylmethyl)piperidin-4-ol is sourced from PubChem (CID 22323165), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).