6-methoxy-5,5-dimethylpiperidin-2-one

C8H15NO2 — CID 19866784

IUPAC6-methoxy-5,5-dimethylpiperidin-2-one
SMILESCOC1NC(=O)CCC1(C)C
InChIInChI=1S/C8H15NO2/c1-8(2)5-4-6(10)9-7(8)11-3/h7H,4-5H2,1-3H3,(H,9,10)
InChIKeyLUAJRHWGIZVFHK-UHFFFAOYSA-N
MW157.21 g/mol
LogP0.90
Rot. Bonds1

About 6-methoxy-5,5-dimethylpiperidin-2-one

6-methoxy-5,5-dimethylpiperidin-2-one (PubChem CID 19866784) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 6-methoxy-5,5-dimethylpiperidin-2-one.

Molecular Properties

Compound Name6-methoxy-5,5-dimethylpiperidin-2-one
PubChem CID19866784
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name6-methoxy-5,5-dimethylpiperidin-2-one
SMILESCOC1NC(=O)CCC1(C)C
InChIInChI=1S/C8H15NO2/c1-8(2)5-4-6(10)9-7(8)11-3/h7H,4-5H2,1-3H3,(H,9,10)
InChIKeyLUAJRHWGIZVFHK-UHFFFAOYSA-N
XLogP0.90
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 50.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-Methoxypiperidin-2-one
CID 566665
2-Oxa-6-azaspiro[3.5]nonan-7-one
CID 145867125
Ethyl 3-methyl-6-oxopiperidine-3-carboxylate
CID 19019560
2-Piperidinone, 6-ethoxy-
CID 12220376
6-Butoxypiperidin-2-one
CID 12502851
(4R)-6-methoxy-4-methylpiperidin-2-one
CID 135045195
6-Ethoxy-4,4-dimethylpiperidin-2-one
CID 12202096
6-Ethoxy-4-methylpiperidin-2-one
CID 21433258
5-(Methoxymethyl)piperidin-2-one
CID 54131446
6-Hydroxy-5,5-dimethylpiperidin-2-one
CID 55286125
5-(Ethoxymethyl)piperidin-2-one
CID 57319799
6-Methoxy-4-methylpiperidin-2-one
CID 72236411

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-5,5-dimethylpiperidin-2-one?
The IUPAC name of 6-methoxy-5,5-dimethylpiperidin-2-one (CID 19866784) is 6-methoxy-5,5-dimethylpiperidin-2-one.
What is the SMILES notation for 6-methoxy-5,5-dimethylpiperidin-2-one?
The canonical SMILES for 6-methoxy-5,5-dimethylpiperidin-2-one is COC1NC(=O)CCC1(C)C.
What is the InChIKey of 6-methoxy-5,5-dimethylpiperidin-2-one?
The InChIKey is LUAJRHWGIZVFHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-8(2)5-4-6(10)9-7(8)11-3/h7H,4-5H2,1-3H3,(H,9,10).
What are the key properties of 6-methoxy-5,5-dimethylpiperidin-2-one?
6-methoxy-5,5-dimethylpiperidin-2-one has a molecular weight of 157.21 g/mol, XLogP of 0.90, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-5,5-dimethylpiperidin-2-one is sourced from PubChem (CID 19866784), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).