3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one

C16H15NO2 — CID 23270940

IUPAC3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one
SMILESCc1ccc(N2CC(c3ccccc3)OC2=O)cc1
InChIInChI=1S/C16H15NO2/c1-12-7-9-14(10-8-12)17-11-15(19-16(17)18)13-5-3-2-4-6-13/h2-10,15H,11H2,1H3
InChIKeyGEEBFMIXKHRGNU-UHFFFAOYSA-N
MW253.30 g/mol
LogP3.69
Rot. Bonds2

About 3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one

3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one (PubChem CID 23270940) has the molecular formula C16H15NO2 and a molecular weight of 253.30 g/mol. Its IUPAC name is 3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one
PubChem CID23270940
Molecular FormulaC16H15NO2
Molecular Weight253.30 g/mol
Exact Mass253.11
IUPAC Name3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one
SMILESCc1ccc(N2CC(c3ccccc3)OC2=O)cc1
InChIInChI=1S/C16H15NO2/c1-12-7-9-14(10-8-12)17-11-15(19-16(17)18)13-5-3-2-4-6-13/h2-10,15H,11H2,1H3
InChIKeyGEEBFMIXKHRGNU-UHFFFAOYSA-N
XLogP3.69
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.30
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one?
The IUPAC name of 3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one (CID 23270940) is 3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one?
The canonical SMILES for 3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one is Cc1ccc(N2CC(c3ccccc3)OC2=O)cc1.
What is the InChIKey of 3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one?
The InChIKey is GEEBFMIXKHRGNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO2/c1-12-7-9-14(10-8-12)17-11-15(19-16(17)18)13-5-3-2-4-6-13/h2-10,15H,11H2,1H3.
What are the key properties of 3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one?
3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one has a molecular weight of 253.30 g/mol, XLogP of 3.69, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methylphenyl)-5-phenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 23270940), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).