2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol

C20H33NO — CID 21421710

IUPAC2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol
SMILESCc1cc(C2CC(C)(C)NC(C)(C)C2)cc(C(C)(C)C)c1O
InChIInChI=1S/C20H33NO/c1-13-9-14(10-16(17(13)22)18(2,3)4)15-11-19(5,6)21-20(7,8)12-15/h9-10,15,21-22H,11-12H2,1-8H3
InChIKeyJDVYBHRRGWBYQE-UHFFFAOYSA-N
MW303.49 g/mol
LogP5.02
Rot. Bonds1

About 2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol

2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol (PubChem CID 21421710) has the molecular formula C20H33NO and a molecular weight of 303.49 g/mol. Its IUPAC name is 2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol.

Molecular Properties

Compound Name2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol
PubChem CID21421710
Molecular FormulaC20H33NO
Molecular Weight303.49 g/mol
Exact Mass303.26
IUPAC Name2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol
SMILESCc1cc(C2CC(C)(C)NC(C)(C)C2)cc(C(C)(C)C)c1O
InChIInChI=1S/C20H33NO/c1-13-9-14(10-16(17(13)22)18(2,3)4)15-11-19(5,6)21-20(7,8)12-15/h9-10,15,21-22H,11-12H2,1-8H3
InChIKeyJDVYBHRRGWBYQE-UHFFFAOYSA-N
XLogP5.02
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500303.49
LogP ≤ 55.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

bis(2,2,6,6-tetramethylpiperidin-4-yl) 2-[(3-tert-butyl-4-hydroxy-5-methylphenyl)methyl]-2-prop-2-enylpropanedioate
CID 58003310
2-tert-butyl-4,6-dimethylphenol
CID 87814182
bis(2,2,6,6-tetramethylpiperidin-4-yl) 2,2-bis[(4-tert-butyl-3-hydroxy-2,6-dimethylphenyl)methyl]propanedioate
CID 23342538
2,2,6,6-tetramethyl-4-phenylpiperidine
CID 11481361
2-tert-butyl-4-[(E)-2-(3-tert-butyl-4-hydroxy-5-methylphenyl)ethenyl]-6-methylphenol
CID 22321426
2-tert-butyl-6-methyl-4-[1,2,2-tris(3-tert-butyl-4-hydroxy-5-methylphenyl)ethyl]phenol
CID 22725885
4-[(2S)-azetidin-2-yl]-2,6-ditert-butylphenol
CID 171196611
2,6-ditert-butyl-4-[(2S)-2-hydroxy-3-[(2,2,6,6-tetramethylpiperidin-4-yl)amino]propoxy]phenol
CID 1311869
2,3-bis(1-adamantyl)-6-tert-butyl-4-methylphenol
CID 87124942
2-[(3-tert-butyl-4-hydroxy-5-methylphenyl)methylidene]-1,3-thiazolidin-4-one
CID 173310864
2-tert-butyl-4-[(3-tert-butyl-4-hydroxy-5-methylphenyl)-dihydroxy-oxo-λ6-sulfanyl]-6-methylphenol
CID 88811570
2-tert-butyl-6-methyl-4-(2-methylbutan-2-yl)phenol
CID 20689836

Frequently Asked Questions

What is the IUPAC name of 2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol?
The IUPAC name of 2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol (CID 21421710) is 2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol.
What is the SMILES notation for 2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol?
The canonical SMILES for 2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol is Cc1cc(C2CC(C)(C)NC(C)(C)C2)cc(C(C)(C)C)c1O.
What is the InChIKey of 2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol?
The InChIKey is JDVYBHRRGWBYQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33NO/c1-13-9-14(10-16(17(13)22)18(2,3)4)15-11-19(5,6)21-20(7,8)12-15/h9-10,15,21-22H,11-12H2,1-8H3.
What are the key properties of 2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol?
2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol has a molecular weight of 303.49 g/mol, XLogP of 5.02, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-tert-butyl-6-methyl-4-(2,2,6,6-tetramethylpiperidin-4-yl)phenol is sourced from PubChem (CID 21421710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).