3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one

C20H23NO3Si — CID 24879940

IUPAC3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one
SMILESC[Si](C)(c1ccccc1)[C@@H](CC(=O)N1CCOC1=O)c1ccccc1
InChIInChI=1S/C20H23NO3Si/c1-25(2,17-11-7-4-8-12-17)18(16-9-5-3-6-10-16)15-19(22)21-13-14-24-20(21)23/h3-12,18H,13-15H2,1-2H3/t18-/m0/s1
InChIKeyZNAOXVHSPVBEJV-SFHVURJKSA-N
MW353.49 g/mol
LogP3.29
Rot. Bonds5

About 3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one

3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one (PubChem CID 24879940) has the molecular formula C20H23NO3Si and a molecular weight of 353.49 g/mol. Its IUPAC name is 3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one
PubChem CID24879940
Molecular FormulaC20H23NO3Si
Molecular Weight353.49 g/mol
Exact Mass353.14
IUPAC Name3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one
SMILESC[Si](C)(c1ccccc1)[C@@H](CC(=O)N1CCOC1=O)c1ccccc1
InChIInChI=1S/C20H23NO3Si/c1-25(2,17-11-7-4-8-12-17)18(16-9-5-3-6-10-16)15-19(22)21-13-14-24-20(21)23/h3-12,18H,13-15H2,1-2H3/t18-/m0/s1
InChIKeyZNAOXVHSPVBEJV-SFHVURJKSA-N
XLogP3.29
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.49
LogP ≤ 53.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

3-(6-Phenylhexanoyl) oxazolidin-2-one
CID 101746948
3-[6-(4-Methylphenyl)hexanoyl]-1,3-oxazolidin-2-one
CID 132141138
3-[6-(3-Methylphenyl)hexanoyl]-1,3-oxazolidin-2-one
CID 132141223
3-[6-[3-(Trifluoromethyl)phenyl]hexanoyl]-1,3-oxazolidin-2-one
CID 145976181
2-Oxazolidinone, 3-(1-oxodecyl)-4-(phenylmethyl)-, (4S)-
CID 10496737
3-[5-(4-Fluorophenyl)pentanoyl]-1,3-oxazolidin-2-one
CID 71098231
3-[6-(3-Fluorophenyl)hexanoyl]-1,3-oxazolidin-2-one
CID 132141210
3-[6-(3-Iodophenyl)hexanoyl]-1,3-oxazolidin-2-one
CID 145965726
3-[6-[4-(Trifluoromethyl)phenyl]hexanoyl]-1,3-oxazolidin-2-one
CID 145970283
(4R)-4-methyl-3-(6-phenylhexanoyl)-1,3-oxazolidin-2-one
CID 132155630
3-[6-(4-Iodophenyl)hexanoyl]-1,3-oxazolidin-2-one
CID 145968019
3-[6-(3,4-Dimethylphenyl)hexanoyl]-1,3-oxazolidin-2-one
CID 145974369

Frequently Asked Questions

What is the IUPAC name of 3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one (CID 24879940) is 3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one is C[Si](C)(c1ccccc1)[C@@H](CC(=O)N1CCOC1=O)c1ccccc1.
What is the InChIKey of 3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one?
The InChIKey is ZNAOXVHSPVBEJV-SFHVURJKSA-N. The full InChI is InChI=1S/C20H23NO3Si/c1-25(2,17-11-7-4-8-12-17)18(16-9-5-3-6-10-16)15-19(22)21-13-14-24-20(21)23/h3-12,18H,13-15H2,1-2H3/t18-/m0/s1.
What are the key properties of 3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one?
3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one has a molecular weight of 353.49 g/mol, XLogP of 3.29, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3S)-3-[dimethyl(phenyl)silyl]-3-phenylpropanoyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 24879940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).