3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one

C13H25NO3Si — CID 11608751

IUPAC3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one
SMILESC=C1CN(CCCO[Si](C)(C)C(C)(C)C)C(=O)O1
InChIInChI=1S/C13H25NO3Si/c1-11-10-14(12(15)17-11)8-7-9-16-18(5,6)13(2,3)4/h1,7-10H2,2-6H3
InChIKeyZODODEKFHGBNDG-UHFFFAOYSA-N
MW271.43 g/mol
LogP3.36
Rot. Bonds5

About 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one

3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one (PubChem CID 11608751) has the molecular formula C13H25NO3Si and a molecular weight of 271.43 g/mol. Its IUPAC name is 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one
PubChem CID11608751
Molecular FormulaC13H25NO3Si
Molecular Weight271.43 g/mol
Exact Mass271.16
IUPAC Name3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one
SMILESC=C1CN(CCCO[Si](C)(C)C(C)(C)C)C(=O)O1
InChIInChI=1S/C13H25NO3Si/c1-11-10-14(12(15)17-11)8-7-9-16-18(5,6)13(2,3)4/h1,7-10H2,2-6H3
InChIKeyZODODEKFHGBNDG-UHFFFAOYSA-N
XLogP3.36
TPSA38.77 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.43
LogP ≤ 53.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-bromo-1-[3-[tert-butyl(dimethyl)silyl]oxypropyl]piperidin-2-one
CID 23114648
2-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1H-pyrrolo[3,4-c]pyridin-3-one
CID 101456517
1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]-1,3-diazinan-2-one
CID 140927699
tert-butyl-[6-[tert-butyl(dimethyl)silyl]oxyhexoxy]-dimethylsilane
CID 6430202
tert-butyl-[5-[tert-butyl(dimethyl)silyl]oxypentoxy]-dimethylsilane
CID 529127
tert-butyl-[10-[tert-butyl(dimethyl)silyl]oxydecoxy]-dimethylsilane
CID 6430197
1-[2-[tert-butyl(dimethyl)silyl]oxyethyl]piperidin-2-one
CID 58604092
tert-butyl-[3-(3,4-dihydro-1H-isoquinolin-2-yl)propoxy]-dimethylsilane
CID 152675325
5-(2-aminopropyl)-1-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-2,3-dihydroindole-7-carboxamide
CID 77386307
3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-1-phenyl-1,3-diazinane-2,4-dione
CID 58719562
2-[5-[tert-butyl(dimethyl)silyl]oxypentyl]isoindole-1,3-dione
CID 159105396
azane;butoxy-tert-butyl-dimethylsilane
CID 87971025

Frequently Asked Questions

What is the IUPAC name of 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one?
The IUPAC name of 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one (CID 11608751) is 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one is C=C1CN(CCCO[Si](C)(C)C(C)(C)C)C(=O)O1.
What is the InChIKey of 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one?
The InChIKey is ZODODEKFHGBNDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25NO3Si/c1-11-10-14(12(15)17-11)8-7-9-16-18(5,6)13(2,3)4/h1,7-10H2,2-6H3.
What are the key properties of 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one?
3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one has a molecular weight of 271.43 g/mol, XLogP of 3.36, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-[tert-butyl(dimethyl)silyl]oxypropyl]-5-methylidene-1,3-oxazolidin-2-one is sourced from PubChem (CID 11608751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).