(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate

C12H23NO4 — CID 59510563

IUPAC(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate
SMILESCC(=O)OCON1C(C)(C)CC(O)CC1(C)C
InChIInChI=1S/C12H23NO4/c1-9(14)16-8-17-13-11(2,3)6-10(15)7-12(13,4)5/h10,15H,6-8H2,1-5H3
InChIKeySREQOGGAEJTTSS-UHFFFAOYSA-N
MW245.32 g/mol
LogP1.45
Rot. Bonds3

About (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate

(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate (PubChem CID 59510563) has the molecular formula C12H23NO4 and a molecular weight of 245.32 g/mol. Its IUPAC name is (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate.

Molecular Properties

Compound Name(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate
PubChem CID59510563
Molecular FormulaC12H23NO4
Molecular Weight245.32 g/mol
Exact Mass245.16
IUPAC Name(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate
SMILESCC(=O)OCON1C(C)(C)CC(O)CC1(C)C
InChIInChI=1S/C12H23NO4/c1-9(14)16-8-17-13-11(2,3)6-10(15)7-12(13,4)5/h10,15H,6-8H2,1-5H3
InChIKeySREQOGGAEJTTSS-UHFFFAOYSA-N
XLogP1.45
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

Analyze (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate 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 (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate?
The IUPAC name of (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate (CID 59510563) is (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate.
What is the SMILES notation for (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate?
The canonical SMILES for (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate is CC(=O)OCON1C(C)(C)CC(O)CC1(C)C.
What is the InChIKey of (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate?
The InChIKey is SREQOGGAEJTTSS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23NO4/c1-9(14)16-8-17-13-11(2,3)6-10(15)7-12(13,4)5/h10,15H,6-8H2,1-5H3.
What are the key properties of (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate?
(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate has a molecular weight of 245.32 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)oxymethyl acetate is sourced from PubChem (CID 59510563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).