4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one

C12H25NO2Si — CID 85377811

IUPAC4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one
SMILESCC(C)(C)[Si](C)(C)OCC1CCNC(=O)C1
InChIInChI=1S/C12H25NO2Si/c1-12(2,3)16(4,5)15-9-10-6-7-13-11(14)8-10/h10H,6-9H2,1-5H3,(H,13,14)
InChIKeySPSVOTGSXNOGKR-UHFFFAOYSA-N
MW243.42 g/mol
LogP2.53
Rot. Bonds3

About 4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one

4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one (PubChem CID 85377811) has the molecular formula C12H25NO2Si and a molecular weight of 243.42 g/mol. Its IUPAC name is 4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one.

Molecular Properties

Compound Name4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one
PubChem CID85377811
Molecular FormulaC12H25NO2Si
Molecular Weight243.42 g/mol
Exact Mass243.17
IUPAC Name4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one
SMILESCC(C)(C)[Si](C)(C)OCC1CCNC(=O)C1
InChIInChI=1S/C12H25NO2Si/c1-12(2,3)16(4,5)15-9-10-6-7-13-11(14)8-10/h10H,6-9H2,1-5H3,(H,13,14)
InChIKeySPSVOTGSXNOGKR-UHFFFAOYSA-N
XLogP2.53
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.42
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

4-[[tert-butyl(dimethyl)silyl]oxymethyl]pyrrolidin-2-one
CID 90458282
(4R)-4-(methoxymethyl)piperidin-2-one
CID 124538037
4-(2,2-dimethylpropyl)piperidin-2-one
CID 76727513
4-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexan-1-one
CID 59734106
ethane;(4S)-4-(ethoxymethyl)piperidin-2-one
CID 145338236
tert-butyl-dimethyl-[[(3S)-piperidin-3-yl]methoxy]silane
CID 150934264
4-[[tert-butyl(dimethyl)silyl]oxymethyl]cyclohexan-1-amine
CID 170953372
(5R)-5-[[tert-butyl(dimethyl)silyl]oxymethyl]-3,3-dimethylpyrrolidin-2-one
CID 91799042
4-(2-hydroxyethyl)piperidin-2-one
CID 70203271
cis-(3S,4R)-3-[[tert-butyl(dimethyl)silyl]oxymethyl]-4-(hydroxymethyl)cyclopentan-1-one
CID 10753716
3-[4-[tert-butyl(dimethyl)silyl]oxybut-1-en-2-yl]pyrrolidin-2-one
CID 89421667
(3aR,4R,6aS)-4-[[tert-butyl(dimethyl)silyl]oxymethyl]-3,3a,4,5,6,6a-hexahydrocyclopenta[b]furan-2-one
CID 67577941

Frequently Asked Questions

What is the IUPAC name of 4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one?
The IUPAC name of 4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one (CID 85377811) is 4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one.
What is the SMILES notation for 4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one?
The canonical SMILES for 4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one is CC(C)(C)[Si](C)(C)OCC1CCNC(=O)C1.
What is the InChIKey of 4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one?
The InChIKey is SPSVOTGSXNOGKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2Si/c1-12(2,3)16(4,5)15-9-10-6-7-13-11(14)8-10/h10H,6-9H2,1-5H3,(H,13,14).
What are the key properties of 4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one?
4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one has a molecular weight of 243.42 g/mol, XLogP of 2.53, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[tert-butyl(dimethyl)silyl]oxymethyl]piperidin-2-one is sourced from PubChem (CID 85377811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).