3-trimethylsilylpiperidin-2-one

C8H17NOSi — CID 46210483

IUPAC3-trimethylsilylpiperidin-2-one
SMILESC[Si](C)(C)C1CCCNC1=O
InChIInChI=1S/C8H17NOSi/c1-11(2,3)7-5-4-6-9-8(7)10/h7H,4-6H2,1-3H3,(H,9,10)
InChIKeyOUCFWVWVBNCYJT-UHFFFAOYSA-N
MW171.32 g/mol
LogP1.60
Rot. Bonds1

About 3-trimethylsilylpiperidin-2-one

3-trimethylsilylpiperidin-2-one (PubChem CID 46210483) has the molecular formula C8H17NOSi and a molecular weight of 171.32 g/mol. Its IUPAC name is 3-trimethylsilylpiperidin-2-one.

Molecular Properties

Compound Name3-trimethylsilylpiperidin-2-one
PubChem CID46210483
Molecular FormulaC8H17NOSi
Molecular Weight171.32 g/mol
Exact Mass171.11
IUPAC Name3-trimethylsilylpiperidin-2-one
SMILESC[Si](C)(C)C1CCCNC1=O
InChIInChI=1S/C8H17NOSi/c1-11(2,3)7-5-4-6-9-8(7)10/h7H,4-6H2,1-3H3,(H,9,10)
InChIKeyOUCFWVWVBNCYJT-UHFFFAOYSA-N
XLogP1.60
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.32
LogP ≤ 51.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-trimethylsilylpiperidin-2-one?
The IUPAC name of 3-trimethylsilylpiperidin-2-one (CID 46210483) is 3-trimethylsilylpiperidin-2-one.
What is the SMILES notation for 3-trimethylsilylpiperidin-2-one?
The canonical SMILES for 3-trimethylsilylpiperidin-2-one is C[Si](C)(C)C1CCCNC1=O.
What is the InChIKey of 3-trimethylsilylpiperidin-2-one?
The InChIKey is OUCFWVWVBNCYJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NOSi/c1-11(2,3)7-5-4-6-9-8(7)10/h7H,4-6H2,1-3H3,(H,9,10).
What are the key properties of 3-trimethylsilylpiperidin-2-one?
3-trimethylsilylpiperidin-2-one has a molecular weight of 171.32 g/mol, XLogP of 1.60, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-trimethylsilylpiperidin-2-one is sourced from PubChem (CID 46210483), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).