1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine

C21H42N2O6 — CID 22892218

IUPAC1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine
SMILESCC1(C)CC(COOCCOOC2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O
InChIInChI=1S/C21H42N2O6/c1-18(2)11-16(12-19(3,4)22(18)24)15-28-26-9-10-27-29-17-13-20(5,6)23(25)21(7,8)14-17/h16-17,24-25H,9-15H2,1-8H3
InChIKeyFOSRFCYBAZESCV-UHFFFAOYSA-N
MW418.58 g/mol
LogP3.95
Rot. Bonds8

About 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine

1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine (PubChem CID 22892218) has the molecular formula C21H42N2O6 and a molecular weight of 418.58 g/mol. Its IUPAC name is 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine.

Molecular Properties

Compound Name1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine
PubChem CID22892218
Molecular FormulaC21H42N2O6
Molecular Weight418.58 g/mol
Exact Mass418.30
IUPAC Name1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine
SMILESCC1(C)CC(COOCCOOC2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O
InChIInChI=1S/C21H42N2O6/c1-18(2)11-16(12-19(3,4)22(18)24)15-28-26-9-10-27-29-17-13-20(5,6)23(25)21(7,8)14-17/h16-17,24-25H,9-15H2,1-8H3
InChIKeyFOSRFCYBAZESCV-UHFFFAOYSA-N
XLogP3.95
TPSA83.86 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500418.58
LogP ≤ 53.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}, {'alert_name': 'peroxide', 'substructure': 'N/A'}

Analyze 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine 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

1-hydroxy-4-[3-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxypropoxy]-2,2,6,6-tetramethylpiperidine
CID 118137024
4-ethoxy-1-hydroxy-2,2,6,6-tetramethylpiperidine
CID 18371974
[4-[2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyethoxy]-2,2,6,6-tetramethylpiperidin-1-yl]oxidanium
CID 149204279
1-hydroxy-4-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2,2,6,6-tetramethylpiperidine
CID 160526152
2-[2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)ethoxy]-2-oxoacetic acid
CID 151971487
1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-2,2,6,6-tetramethylpiperidin-4-amine
CID 91459045
CID 140959559
CID 140959559
4-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methoxy]-4-oxobutanoic acid
CID 151524547
2-[2-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxyethoxy]-N,N-dimethylethanamine
CID 171443286
(2R)-1-(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)oxy-3-methoxypropan-2-ol
CID 139944892
4-(ethoxymethoxy)-1-hydroxy-2,2,6,6-tetramethylpiperidine
CID 21020056
bis(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl) hexanedioate
CID 57039687

Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine?
The IUPAC name of 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine (CID 22892218) is 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine.
What is the SMILES notation for 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine?
The canonical SMILES for 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine is CC1(C)CC(COOCCOOC2CC(C)(C)N(O)C(C)(C)C2)CC(C)(C)N1O.
What is the InChIKey of 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine?
The InChIKey is FOSRFCYBAZESCV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H42N2O6/c1-18(2)11-16(12-19(3,4)22(18)24)15-28-26-9-10-27-29-17-13-20(5,6)23(25)21(7,8)14-17/h16-17,24-25H,9-15H2,1-8H3.
What are the key properties of 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine?
1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine has a molecular weight of 418.58 g/mol, XLogP of 3.95, 8 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-4-[2-[(1-hydroxy-2,2,6,6-tetramethylpiperidin-4-yl)methylperoxy]ethylperoxy]-2,2,6,6-tetramethylpiperidine is sourced from PubChem (CID 22892218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).