1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol

C24H42N4O3 — CID 151982293

IUPAC1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC1(C)CCCC(C)(C)N1ON(ON1C(C)(C)CC(O)CC1(C)C)c1ccccc1N
InChIInChI=1S/C24H42N4O3/c1-21(2)14-11-15-22(3,4)27(21)30-26(20-13-10-9-12-19(20)25)31-28-23(5,6)16-18(29)17-24(28,7)8/h9-10,12-13,18,29H,11,14-17,25H2,1-8H3
InChIKeyUCXYZQULUZBDOQ-UHFFFAOYSA-N
MW434.63 g/mol
LogP4.83
Rot. Bonds5

About 1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol

1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol (PubChem CID 151982293) has the molecular formula C24H42N4O3 and a molecular weight of 434.63 g/mol. Its IUPAC name is 1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol.

Molecular Properties

Compound Name1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol
PubChem CID151982293
Molecular FormulaC24H42N4O3
Molecular Weight434.63 g/mol
Exact Mass434.33
IUPAC Name1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol
SMILESCC1(C)CCCC(C)(C)N1ON(ON1C(C)(C)CC(O)CC1(C)C)c1ccccc1N
InChIInChI=1S/C24H42N4O3/c1-21(2)14-11-15-22(3,4)27(21)30-26(20-13-10-9-12-19(20)25)31-28-23(5,6)16-18(29)17-24(28,7)8/h9-10,12-13,18,29H,11,14-17,25H2,1-8H3
InChIKeyUCXYZQULUZBDOQ-UHFFFAOYSA-N
XLogP4.83
TPSA74.43 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms31
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500434.63
LogP ≤ 54.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol?
The IUPAC name of 1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol (CID 151982293) is 1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol.
What is the SMILES notation for 1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol?
The canonical SMILES for 1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol is CC1(C)CCCC(C)(C)N1ON(ON1C(C)(C)CC(O)CC1(C)C)c1ccccc1N.
What is the InChIKey of 1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol?
The InChIKey is UCXYZQULUZBDOQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H42N4O3/c1-21(2)14-11-15-22(3,4)27(21)30-26(20-13-10-9-12-19(20)25)31-28-23(5,6)16-18(29)17-24(28,7)8/h9-10,12-13,18,29H,11,14-17,25H2,1-8H3.
What are the key properties of 1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol?
1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol has a molecular weight of 434.63 g/mol, XLogP of 4.83, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-amino-N-(2,2,6,6-tetramethylpiperidin-1-yl)oxyanilino)oxy-2,2,6,6-tetramethylpiperidin-4-ol is sourced from PubChem (CID 151982293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).