2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol

C9H19NO2 — CID 11607999

IUPAC2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol
SMILESCC1(C)CC(O)CC(C)(C)[NH+]1[O-]
InChIInChI=1S/C9H19NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h7,10-11H,5-6H2,1-4H3
InChIKeyFAPCFNWEPHTUQK-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.08
Rot. Bonds

About 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol

2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol (PubChem CID 11607999) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol
PubChem CID11607999
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC Name2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol
SMILESCC1(C)CC(O)CC(C)(C)[NH+]1[O-]
InChIInChI=1S/C9H19NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h7,10-11H,5-6H2,1-4H3
InChIKeyFAPCFNWEPHTUQK-UHFFFAOYSA-N
XLogP0.08
TPSA47.73 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-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

Related Compounds

Tempol
CID 137994
1,4-Dihydroxy-2,2,6,6-tetramethylpiperidine
CID 5395
4-Hydroxy-2,2,6,6-tetramethylpiperidine
CID 75471
2,2,6,6-Tetramethyl-1-oxidopiperidin-4-ol
CID 11608000
4-Hydroxy-2,2,6,6-tetramethylpiperidine-1-15N-oxyl
CID 10877621
4-Hydroxy-2,2,6,6-tetramethylpiperidine-d17-1-oxyl
CID 16213359
2,2,6,6-Tetramethyl-1-(2,2,2-trifluoroethoxy)piperidin-4-ol
CID 25229267
1-Methoxy-2,2,6,6-tetramethyl-piperidin-4-ol
CID 10997770
1-Cyclohexyloxy-2,2,6,6-tetramethyl-piperidin-4-ol
CID 11322811
1-Ethoxy-4-hydroxy-2,2,6,6-tetramethylpiperidine
CID 19391741
2,2,6,6-Tetramethyl-1-[(2-methylpropan-2-yl)oxy]piperidin-4-ol
CID 19768384
1-Propoxy-2,2,6,6-tetramethyl-piperidin-4-ol
CID 23450598

Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol?
The IUPAC name of 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol (CID 11607999) is 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol.
What is the SMILES notation for 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol?
The canonical SMILES for 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol is CC1(C)CC(O)CC(C)(C)[NH+]1[O-].
What is the InChIKey of 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol?
The InChIKey is FAPCFNWEPHTUQK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-8(2)5-7(11)6-9(3,4)10(8)12/h7,10-11H,5-6H2,1-4H3.
What are the key properties of 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol?
2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol has a molecular weight of 173.26 g/mol, XLogP of 0.08, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,6,6-tetramethyl-1-oxidopiperidin-1-ium-4-ol is sourced from PubChem (CID 11607999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).