(4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one

C15H13NO2 — CID 10868374

IUPAC(4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one
SMILESO=C1N[C@H](c2ccccc2)[C@H](c2ccccc2)O1
InChIInChI=1S/C15H13NO2/c17-15-16-13(11-7-3-1-4-8-11)14(18-15)12-9-5-2-6-10-12/h1-10,13-14H,(H,16,17)/t13-,14+/m1/s1
InChIKeyLTENIVFVXMCOQI-KGLIPLIRSA-N
MW239.27 g/mol
LogP3.21
Rot. Bonds2

About (4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one

(4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one (PubChem CID 10868374) has the molecular formula C15H13NO2 and a molecular weight of 239.27 g/mol. Its IUPAC name is (4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name(4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one
PubChem CID10868374
Molecular FormulaC15H13NO2
Molecular Weight239.27 g/mol
Exact Mass239.09
IUPAC Name(4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one
SMILESO=C1N[C@H](c2ccccc2)[C@H](c2ccccc2)O1
InChIInChI=1S/C15H13NO2/c17-15-16-13(11-7-3-1-4-8-11)14(18-15)12-9-5-2-6-10-12/h1-10,13-14H,(H,16,17)/t13-,14+/m1/s1
InChIKeyLTENIVFVXMCOQI-KGLIPLIRSA-N
XLogP3.21
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.27
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one?
The IUPAC name of (4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one (CID 10868374) is (4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for (4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one?
The canonical SMILES for (4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one is O=C1N[C@H](c2ccccc2)[C@H](c2ccccc2)O1.
What is the InChIKey of (4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one?
The InChIKey is LTENIVFVXMCOQI-KGLIPLIRSA-N. The full InChI is InChI=1S/C15H13NO2/c17-15-16-13(11-7-3-1-4-8-11)14(18-15)12-9-5-2-6-10-12/h1-10,13-14H,(H,16,17)/t13-,14+/m1/s1.
What are the key properties of (4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one?
(4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one has a molecular weight of 239.27 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R,5S)-4,5-diphenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 10868374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).