5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one

C24H21NO3 — CID 134852879

IUPAC5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one
SMILESO=C(CCc1ccccc1)N1CC(c2ccccc2)(c2ccccc2)OC1=O
InChIInChI=1S/C24H21NO3/c26-22(17-16-19-10-4-1-5-11-19)25-18-24(28-23(25)27,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15H,16-18H2
InChIKeyDUBFCFWYMUOFIE-UHFFFAOYSA-N
MW371.44 g/mol
LogP4.54
Rot. Bonds5

About 5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one

5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one (PubChem CID 134852879) has the molecular formula C24H21NO3 and a molecular weight of 371.44 g/mol. Its IUPAC name is 5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one
PubChem CID134852879
Molecular FormulaC24H21NO3
Molecular Weight371.44 g/mol
Exact Mass371.15
IUPAC Name5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one
SMILESO=C(CCc1ccccc1)N1CC(c2ccccc2)(c2ccccc2)OC1=O
InChIInChI=1S/C24H21NO3/c26-22(17-16-19-10-4-1-5-11-19)25-18-24(28-23(25)27,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15H,16-18H2
InChIKeyDUBFCFWYMUOFIE-UHFFFAOYSA-N
XLogP4.54
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.44
LogP ≤ 54.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one?
The IUPAC name of 5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one (CID 134852879) is 5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one.
What is the SMILES notation for 5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one?
The canonical SMILES for 5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one is O=C(CCc1ccccc1)N1CC(c2ccccc2)(c2ccccc2)OC1=O.
What is the InChIKey of 5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one?
The InChIKey is DUBFCFWYMUOFIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21NO3/c26-22(17-16-19-10-4-1-5-11-19)25-18-24(28-23(25)27,20-12-6-2-7-13-20)21-14-8-3-9-15-21/h1-15H,16-18H2.
What are the key properties of 5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one?
5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one has a molecular weight of 371.44 g/mol, XLogP of 4.54, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5-diphenyl-3-(3-phenylpropanoyl)-1,3-oxazolidin-2-one is sourced from PubChem (CID 134852879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).