2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol

C20H41NO2 — CID 23159798

IUPAC2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol
SMILESCCCCCCCCCCCON1C(C)(C)CC(O)CC1(C)C
InChIInChI=1S/C20H41NO2/c1-6-7-8-9-10-11-12-13-14-15-23-21-19(2,3)16-18(22)17-20(21,4)5/h18,22H,6-17H2,1-5H3
InChIKeyHOFGCQIHAZYFTI-UHFFFAOYSA-N
MW327.55 g/mol
LogP5.46
Rot. Bonds11

About 2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol

2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol (PubChem CID 23159798) has the molecular formula C20H41NO2 and a molecular weight of 327.55 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol
PubChem CID23159798
Molecular FormulaC20H41NO2
Molecular Weight327.55 g/mol
Exact Mass327.31
IUPAC Name2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol
SMILESCCCCCCCCCCCON1C(C)(C)CC(O)CC1(C)C
InChIInChI=1S/C20H41NO2/c1-6-7-8-9-10-11-12-13-14-15-23-21-19(2,3)16-18(22)17-20(21,4)5/h18,22H,6-17H2,1-5H3
InChIKeyHOFGCQIHAZYFTI-UHFFFAOYSA-N
XLogP5.46
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500327.55
LogP ≤ 55.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2,2,6,6-tetramethyl-1-octoxypiperidin-4-ol
CID 11346683
ethane;1-hexoxy-2,2,6,6-tetramethylpiperidin-4-ol
CID 143602726
bis(2,2,6,6-tetramethyl-1-octoxypiperidin-4-yl) propanedioate;methane
CID 159199816
(1,2,2,6,6-pentamethylpiperidin-4-yl) (2,2,6,6-tetramethyl-1-undecoxypiperidin-4-yl) carbonate
CID 58112264
4-O-(1-decoxy-2,2,6,6-tetramethylpiperidin-4-yl) 1-O-(1-ethoxy-2,2,6,6-tetramethylpiperidin-4-yl) butanedioate
CID 156550746
4-oxo-4-(2,2,6,6-tetramethyl-1-undecoxypiperidin-4-yl)oxybutanoic acid
CID 155213134
2-(2,2,6,6-tetramethyl-1-undecoxypiperidin-4-yl)phenol
CID 175160765
2,2-bis(2,2,6,6-tetramethyl-1-octoxypiperidin-4-yl)decanoic acid
CID 157140421
4-hydroxy-N-(2,2,6,6-tetramethyl-1-octoxypiperidin-4-yl)butanamide
CID 139642514
bis(2,2,6,6-tetramethyl-1-octoxypiperidin-4-yl) benzene-1,2-dicarboxylate
CID 151973385
4-O-[2-(4-hydroxy-2,2,6,6-tetramethylpiperidin-1-yl)ethyl] 1-O-methyl butanedioate;1-O-(1,2,2,6,6-pentamethylpiperidin-4-yl) 10-O-(2,2,6,6-tetramethyl-1-octoxypiperidin-4-yl) decanedioate
CID 123159299
1-(methoxymethoxy)-2,2,6,6-tetramethylpiperidin-4-ol
CID 25033837

Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol?
The IUPAC name of 2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol (CID 23159798) is 2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol.
What is the SMILES notation for 2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol?
The canonical SMILES for 2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol is CCCCCCCCCCCON1C(C)(C)CC(O)CC1(C)C.
What is the InChIKey of 2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol?
The InChIKey is HOFGCQIHAZYFTI-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H41NO2/c1-6-7-8-9-10-11-12-13-14-15-23-21-19(2,3)16-18(22)17-20(21,4)5/h18,22H,6-17H2,1-5H3.
What are the key properties of 2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol?
2,2,6,6-tetramethyl-1-undecoxypiperidin-4-ol has a molecular weight of 327.55 g/mol, XLogP of 5.46, 11 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-undecoxypiperidin-4-ol is sourced from PubChem (CID 23159798), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).