2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol

C13H27NO2 — CID 174827050

IUPAC2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol
SMILESCCOC1CC(C)(C)N(CCO)C(C)(C)C1
InChIInChI=1S/C13H27NO2/c1-6-16-11-9-12(2,3)14(7-8-15)13(4,5)10-11/h11,15H,6-10H2,1-5H3
InChIKeyICELEJDSTVJLRB-UHFFFAOYSA-N
MW229.36 g/mol
LogP2.04
Rot. Bonds4

About 2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol

2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol (PubChem CID 174827050) has the molecular formula C13H27NO2 and a molecular weight of 229.36 g/mol. Its IUPAC name is 2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol.

Molecular Properties

Compound Name2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol
PubChem CID174827050
Molecular FormulaC13H27NO2
Molecular Weight229.36 g/mol
Exact Mass229.20
IUPAC Name2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol
SMILESCCOC1CC(C)(C)N(CCO)C(C)(C)C1
InChIInChI=1S/C13H27NO2/c1-6-16-11-9-12(2,3)14(7-8-15)13(4,5)10-11/h11,15H,6-10H2,1-5H3
InChIKeyICELEJDSTVJLRB-UHFFFAOYSA-N
XLogP2.04
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.36
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol?
The IUPAC name of 2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol (CID 174827050) is 2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol.
What is the SMILES notation for 2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol?
The canonical SMILES for 2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol is CCOC1CC(C)(C)N(CCO)C(C)(C)C1.
What is the InChIKey of 2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol?
The InChIKey is ICELEJDSTVJLRB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27NO2/c1-6-16-11-9-12(2,3)14(7-8-15)13(4,5)10-11/h11,15H,6-10H2,1-5H3.
What are the key properties of 2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol?
2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol has a molecular weight of 229.36 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethoxy-2,2,6,6-tetramethylpiperidin-1-yl)ethanol is sourced from PubChem (CID 174827050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).