5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one

C15H29NO2Si — CID 75045772

IUPAC5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one
SMILESC=CCN1C(=O)CCC(O[Si](C)(C)C(C)(C)C)C1C
InChIInChI=1S/C15H29NO2Si/c1-8-11-16-12(2)13(9-10-14(16)17)18-19(6,7)15(3,4)5/h8,12-13H,1,9-11H2,2-7H3
InChIKeyIRGIBJHXYNLYIC-UHFFFAOYSA-N
MW283.49 g/mol
LogP3.57
Rot. Bonds4

About 5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one

5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one (PubChem CID 75045772) has the molecular formula C15H29NO2Si and a molecular weight of 283.49 g/mol. Its IUPAC name is 5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one.

Molecular Properties

Compound Name5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one
PubChem CID75045772
Molecular FormulaC15H29NO2Si
Molecular Weight283.49 g/mol
Exact Mass283.20
IUPAC Name5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one
SMILESC=CCN1C(=O)CCC(O[Si](C)(C)C(C)(C)C)C1C
InChIInChI=1S/C15H29NO2Si/c1-8-11-16-12(2)13(9-10-14(16)17)18-19(6,7)15(3,4)5/h8,12-13H,1,9-11H2,2-7H3
InChIKeyIRGIBJHXYNLYIC-UHFFFAOYSA-N
XLogP3.57
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.49
LogP ≤ 53.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one?
The IUPAC name of 5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one (CID 75045772) is 5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one.
What is the SMILES notation for 5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one?
The canonical SMILES for 5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one is C=CCN1C(=O)CCC(O[Si](C)(C)C(C)(C)C)C1C.
What is the InChIKey of 5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one?
The InChIKey is IRGIBJHXYNLYIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NO2Si/c1-8-11-16-12(2)13(9-10-14(16)17)18-19(6,7)15(3,4)5/h8,12-13H,1,9-11H2,2-7H3.
What are the key properties of 5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one?
5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one has a molecular weight of 283.49 g/mol, XLogP of 3.57, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[tert-butyl(dimethyl)silyl]oxy-6-methyl-1-prop-2-enylpiperidin-2-one is sourced from PubChem (CID 75045772), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).