1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride

C9H18ClNO2 — CID 2733527

IUPAC1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride
SMILESCC1(C)CC(=O)CC(C)(C)N1O.Cl
InChIInChI=1S/C9H17NO2.ClH/c1-8(2)5-7(11)6-9(3,4)10(8)12;/h12H,5-6H2,1-4H3;1H
InChIKeyRGXIVJSWGDTZCA-UHFFFAOYSA-N
MW207.70 g/mol
LogP2.02
Rot. Bonds

About 1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride

1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride (PubChem CID 2733527) has the molecular formula C9H18ClNO2 and a molecular weight of 207.70 g/mol. Its IUPAC name is 1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride.

Molecular Properties

Compound Name1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride
PubChem CID2733527
Molecular FormulaC9H18ClNO2
Molecular Weight207.70 g/mol
Exact Mass207.10
IUPAC Name1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride
SMILESCC1(C)CC(=O)CC(C)(C)N1O.Cl
InChIInChI=1S/C9H17NO2.ClH/c1-8(2)5-7(11)6-9(3,4)10(8)12;/h12H,5-6H2,1-4H3;1H
InChIKeyRGXIVJSWGDTZCA-UHFFFAOYSA-N
XLogP2.02
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.70
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride?
The IUPAC name of 1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride (CID 2733527) is 1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride.
What is the SMILES notation for 1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride?
The canonical SMILES for 1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride is CC1(C)CC(=O)CC(C)(C)N1O.Cl.
What is the InChIKey of 1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride?
The InChIKey is RGXIVJSWGDTZCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO2.ClH/c1-8(2)5-7(11)6-9(3,4)10(8)12;/h12H,5-6H2,1-4H3;1H.
What are the key properties of 1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride?
1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride has a molecular weight of 207.70 g/mol, XLogP of 2.02, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-hydroxy-2,2,6,6-tetramethylpiperidin-4-one;hydrochloride is sourced from PubChem (CID 2733527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).