4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one

C22H19NO2 — CID 4527113

IUPAC4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one
SMILESO=C1NC(Cc2ccccc2)C(c2ccccc2)(c2ccccc2)O1
InChIInChI=1S/C22H19NO2/c24-21-23-20(16-17-10-4-1-5-11-17)22(25-21,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16H2,(H,23,24)
InChIKeyXVHANMSUSBZRCX-UHFFFAOYSA-N
MW329.40 g/mol
LogP4.28
Rot. Bonds4

About 4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one

4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one (PubChem CID 4527113) has the molecular formula C22H19NO2 and a molecular weight of 329.40 g/mol. Its IUPAC name is 4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one
PubChem CID4527113
Molecular FormulaC22H19NO2
Molecular Weight329.40 g/mol
Exact Mass329.14
IUPAC Name4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one
SMILESO=C1NC(Cc2ccccc2)C(c2ccccc2)(c2ccccc2)O1
InChIInChI=1S/C22H19NO2/c24-21-23-20(16-17-10-4-1-5-11-17)22(25-21,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16H2,(H,23,24)
InChIKeyXVHANMSUSBZRCX-UHFFFAOYSA-N
XLogP4.28
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.40
LogP ≤ 54.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one?
The IUPAC name of 4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one (CID 4527113) is 4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one.
What is the SMILES notation for 4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one?
The canonical SMILES for 4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one is O=C1NC(Cc2ccccc2)C(c2ccccc2)(c2ccccc2)O1.
What is the InChIKey of 4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one?
The InChIKey is XVHANMSUSBZRCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19NO2/c24-21-23-20(16-17-10-4-1-5-11-17)22(25-21,18-12-6-2-7-13-18)19-14-8-3-9-15-19/h1-15,20H,16H2,(H,23,24).
What are the key properties of 4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one?
4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one has a molecular weight of 329.40 g/mol, XLogP of 4.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-5,5-diphenyl-1,3-oxazolidin-2-one is sourced from PubChem (CID 4527113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).