1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol

C12H25NO2 — CID 141097112

IUPAC1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol
SMILESCCC(O)OC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C12H25NO2/c1-6-10(14)15-9-7-11(2,3)13-12(4,5)8-9/h9-10,13-14H,6-8H2,1-5H3
InChIKeyIQUJSKJKTWNZML-UHFFFAOYSA-N
MW215.34 g/mol
LogP2.04
Rot. Bonds3

About 1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol

1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol (PubChem CID 141097112) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol.

Molecular Properties

Compound Name1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol
PubChem CID141097112
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol
SMILESCCC(O)OC1CC(C)(C)NC(C)(C)C1
InChIInChI=1S/C12H25NO2/c1-6-10(14)15-9-7-11(2,3)13-12(4,5)8-9/h9-10,13-14H,6-8H2,1-5H3
InChIKeyIQUJSKJKTWNZML-UHFFFAOYSA-N
XLogP2.04
TPSA41.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 52.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol?
The IUPAC name of 1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol (CID 141097112) is 1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol.
What is the SMILES notation for 1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol?
The canonical SMILES for 1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol is CCC(O)OC1CC(C)(C)NC(C)(C)C1.
What is the InChIKey of 1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol?
The InChIKey is IQUJSKJKTWNZML-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-6-10(14)15-9-7-11(2,3)13-12(4,5)8-9/h9-10,13-14H,6-8H2,1-5H3.
What are the key properties of 1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol?
1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol has a molecular weight of 215.34 g/mol, XLogP of 2.04, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,2,6,6-tetramethylpiperidin-4-yl)oxypropan-1-ol is sourced from PubChem (CID 141097112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).