methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate

C11H21NO3 — CID 3367709

IUPACmethyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate
SMILESCOC(=O)C1CC(C)(C)N(O)C(C)(C)C1
InChIInChI=1S/C11H21NO3/c1-10(2)6-8(9(13)15-5)7-11(3,4)12(10)14/h8,14H,6-7H2,1-5H3
InChIKeyMMMJKCJKQUNPKF-UHFFFAOYSA-N
MW215.29 g/mol
LogP1.82
Rot. Bonds1

About methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate

methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate (PubChem CID 3367709) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate.

Molecular Properties

Compound Namemethyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate
PubChem CID3367709
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC Namemethyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate
SMILESCOC(=O)C1CC(C)(C)N(O)C(C)(C)C1
InChIInChI=1S/C11H21NO3/c1-10(2)6-8(9(13)15-5)7-11(3,4)12(10)14/h8,14H,6-7H2,1-5H3
InChIKeyMMMJKCJKQUNPKF-UHFFFAOYSA-N
XLogP1.82
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 51.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

Tempo carboxylic acid
CID 3080786
1-Acetoxy-4-methoxycarbonyl-2,2,6,6-tetramethylpiperidine
CID 3515264
4-Piperidinecarboxylic acid, 2,2,6,6-tetramethyl-, methyl ester
CID 93960
1-Hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylic acid
CID 688186
1-Methoxy-2,2,6,6-tetramethyl piperidine-4-carboxylate
CID 17953313
CID 58113715
CID 58113715
4-Carboxylate-2,2,6,6-tetramethylpiperidine-N-oxyl
CID 71297228
1-Hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-carboxylic acid chloride
CID 139244692
Ethyl 1-hydroxy-2,2,6,6-tetramethylpiperidin-1-ium-4-carboxylate chloride
CID 139244693
1-(Fluoromethoxy)-2,2,6,6-tetramethylpiperidine-4-carboxylic acid
CID 122395585
2,2,6,6-Tetramethyl-1-oxidopiperidine-4-carboxylic acid
CID 12255236
Acetyloxymethyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate
CID 15550092

Frequently Asked Questions

What is the IUPAC name of methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate?
The IUPAC name of methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate (CID 3367709) is methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate.
What is the SMILES notation for methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate?
The canonical SMILES for methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate is COC(=O)C1CC(C)(C)N(O)C(C)(C)C1.
What is the InChIKey of methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate?
The InChIKey is MMMJKCJKQUNPKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-10(2)6-8(9(13)15-5)7-11(3,4)12(10)14/h8,14H,6-7H2,1-5H3.
What are the key properties of methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate?
methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate has a molecular weight of 215.29 g/mol, XLogP of 1.82, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methyl 1-hydroxy-2,2,6,6-tetramethylpiperidine-4-carboxylate is sourced from PubChem (CID 3367709), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).