2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol

C17H27NO2 — CID 12068227

IUPAC2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol
SMILESCC(ON1C(C)(C)CC(O)CC1(C)C)c1ccccc1
InChIInChI=1S/C17H27NO2/c1-13(14-9-7-6-8-10-14)20-18-16(2,3)11-15(19)12-17(18,4)5/h6-10,13,15,19H,11-12H2,1-5H3
InChIKeyAPUFHRLDCFVHFO-UHFFFAOYSA-N
MW277.41 g/mol
LogP3.69
Rot. Bonds3

About 2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol

2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol (PubChem CID 12068227) has the molecular formula C17H27NO2 and a molecular weight of 277.41 g/mol. Its IUPAC name is 2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol.

Molecular Properties

Compound Name2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol
PubChem CID12068227
Molecular FormulaC17H27NO2
Molecular Weight277.41 g/mol
Exact Mass277.20
IUPAC Name2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol
SMILESCC(ON1C(C)(C)CC(O)CC1(C)C)c1ccccc1
InChIInChI=1S/C17H27NO2/c1-13(14-9-7-6-8-10-14)20-18-16(2,3)11-15(19)12-17(18,4)5/h6-10,13,15,19H,11-12H2,1-5H3
InChIKeyAPUFHRLDCFVHFO-UHFFFAOYSA-N
XLogP3.69
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 53.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol?
The IUPAC name of 2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol (CID 12068227) is 2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol.
What is the SMILES notation for 2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol?
The canonical SMILES for 2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol is CC(ON1C(C)(C)CC(O)CC1(C)C)c1ccccc1.
What is the InChIKey of 2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol?
The InChIKey is APUFHRLDCFVHFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27NO2/c1-13(14-9-7-6-8-10-14)20-18-16(2,3)11-15(19)12-17(18,4)5/h6-10,13,15,19H,11-12H2,1-5H3.
What are the key properties of 2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol?
2,2,6,6-tetramethyl-1-(1-phenylethoxy)piperidin-4-ol has a molecular weight of 277.41 g/mol, XLogP of 3.69, 3 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-(1-phenylethoxy)piperidin-4-ol is sourced from PubChem (CID 12068227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).