5-(1-trityloxyethyl)-1,3-oxazolidin-2-one

C24H23NO3 — CID 69241771

IUPAC5-(1-trityloxyethyl)-1,3-oxazolidin-2-one
SMILESCC(OC(c1ccccc1)(c1ccccc1)c1ccccc1)C1CNC(=O)O1
InChIInChI=1S/C24H23NO3/c1-18(22-17-25-23(26)27-22)28-24(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,18,22H,17H2,1H3,(H,25,26)
InChIKeyBUQSNGPAALPPEM-UHFFFAOYSA-N
MW373.45 g/mol
LogP4.49
Rot. Bonds6

About 5-(1-trityloxyethyl)-1,3-oxazolidin-2-one

5-(1-trityloxyethyl)-1,3-oxazolidin-2-one (PubChem CID 69241771) has the molecular formula C24H23NO3 and a molecular weight of 373.45 g/mol. Its IUPAC name is 5-(1-trityloxyethyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-(1-trityloxyethyl)-1,3-oxazolidin-2-one
PubChem CID69241771
Molecular FormulaC24H23NO3
Molecular Weight373.45 g/mol
Exact Mass373.17
IUPAC Name5-(1-trityloxyethyl)-1,3-oxazolidin-2-one
SMILESCC(OC(c1ccccc1)(c1ccccc1)c1ccccc1)C1CNC(=O)O1
InChIInChI=1S/C24H23NO3/c1-18(22-17-25-23(26)27-22)28-24(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,18,22H,17H2,1H3,(H,25,26)
InChIKeyBUQSNGPAALPPEM-UHFFFAOYSA-N
XLogP4.49
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.45
LogP ≤ 54.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triphenyl_methyl-silyl', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 5-(1-trityloxyethyl)-1,3-oxazolidin-2-one?
The IUPAC name of 5-(1-trityloxyethyl)-1,3-oxazolidin-2-one (CID 69241771) is 5-(1-trityloxyethyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-(1-trityloxyethyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 5-(1-trityloxyethyl)-1,3-oxazolidin-2-one is CC(OC(c1ccccc1)(c1ccccc1)c1ccccc1)C1CNC(=O)O1.
What is the InChIKey of 5-(1-trityloxyethyl)-1,3-oxazolidin-2-one?
The InChIKey is BUQSNGPAALPPEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23NO3/c1-18(22-17-25-23(26)27-22)28-24(19-11-5-2-6-12-19,20-13-7-3-8-14-20)21-15-9-4-10-16-21/h2-16,18,22H,17H2,1H3,(H,25,26).
What are the key properties of 5-(1-trityloxyethyl)-1,3-oxazolidin-2-one?
5-(1-trityloxyethyl)-1,3-oxazolidin-2-one has a molecular weight of 373.45 g/mol, XLogP of 4.49, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-trityloxyethyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 69241771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).