3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one

C17H23NO3Si — CID 101064679

IUPAC3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one
SMILESC/C(=C/CCC(=O)N1CCOC1=O)[Si](C)(C)c1ccccc1
InChIInChI=1S/C17H23NO3Si/c1-14(22(2,3)15-9-5-4-6-10-15)8-7-11-16(19)18-12-13-21-17(18)20/h4-6,8-10H,7,11-13H2,1-3H3/b14-8-
InChIKeyXMUQPKWEQITMNM-ZSOIEALJSA-N
MW317.46 g/mol
LogP2.85
Rot. Bonds5

About 3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one

3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one (PubChem CID 101064679) has the molecular formula C17H23NO3Si and a molecular weight of 317.46 g/mol. Its IUPAC name is 3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one
PubChem CID101064679
Molecular FormulaC17H23NO3Si
Molecular Weight317.46 g/mol
Exact Mass317.14
IUPAC Name3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one
SMILESC/C(=C/CCC(=O)N1CCOC1=O)[Si](C)(C)c1ccccc1
InChIInChI=1S/C17H23NO3Si/c1-14(22(2,3)15-9-5-4-6-10-15)8-7-11-16(19)18-12-13-21-17(18)20/h4-6,8-10H,7,11-13H2,1-3H3/b14-8-
InChIKeyXMUQPKWEQITMNM-ZSOIEALJSA-N
XLogP2.85
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.46
LogP ≤ 52.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one (CID 101064679) is 3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one is C/C(=C/CCC(=O)N1CCOC1=O)[Si](C)(C)c1ccccc1.
What is the InChIKey of 3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one?
The InChIKey is XMUQPKWEQITMNM-ZSOIEALJSA-N. The full InChI is InChI=1S/C17H23NO3Si/c1-14(22(2,3)15-9-5-4-6-10-15)8-7-11-16(19)18-12-13-21-17(18)20/h4-6,8-10H,7,11-13H2,1-3H3/b14-8-.
What are the key properties of 3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one?
3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one has a molecular weight of 317.46 g/mol, XLogP of 2.85, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(Z)-5-[dimethyl(phenyl)silyl]hex-4-enoyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 101064679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).