2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol

C10H21NO2 — CID 22341831

IUPAC2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol
SMILESCCC1(C)CC(O)CC(C)(C)N1O
InChIInChI=1S/C10H21NO2/c1-5-10(4)7-8(12)6-9(2,3)11(10)13/h8,12-13H,5-7H2,1-4H3
InChIKeyZQFFPAFFNXZPNM-UHFFFAOYSA-N
MW187.28 g/mol
LogP1.78
Rot. Bonds1

About 2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol

2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol (PubChem CID 22341831) has the molecular formula C10H21NO2 and a molecular weight of 187.28 g/mol. Its IUPAC name is 2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol.

Molecular Properties

Compound Name2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol
PubChem CID22341831
Molecular FormulaC10H21NO2
Molecular Weight187.28 g/mol
Exact Mass187.16
IUPAC Name2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol
SMILESCCC1(C)CC(O)CC(C)(C)N1O
InChIInChI=1S/C10H21NO2/c1-5-10(4)7-8(12)6-9(2,3)11(10)13/h8,12-13H,5-7H2,1-4H3
InChIKeyZQFFPAFFNXZPNM-UHFFFAOYSA-N
XLogP1.78
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500187.28
LogP ≤ 51.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol?
The IUPAC name of 2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol (CID 22341831) is 2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol.
What is the SMILES notation for 2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol?
The canonical SMILES for 2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol is CCC1(C)CC(O)CC(C)(C)N1O.
What is the InChIKey of 2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol?
The InChIKey is ZQFFPAFFNXZPNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO2/c1-5-10(4)7-8(12)6-9(2,3)11(10)13/h8,12-13H,5-7H2,1-4H3.
What are the key properties of 2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol?
2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol has a molecular weight of 187.28 g/mol, XLogP of 1.78, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-hydroxy-2,6,6-trimethylpiperidin-4-ol is sourced from PubChem (CID 22341831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).