5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one

C16H15NO3 — CID 82367269

IUPAC5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one
SMILESCOc1ccc(-c2ccc(C3CNC(=O)O3)cc2)cc1
InChIInChI=1S/C16H15NO3/c1-19-14-8-6-12(7-9-14)11-2-4-13(5-3-11)15-10-17-16(18)20-15/h2-9,15H,10H2,1H3,(H,17,18)
InChIKeyNGXUCKOKBYWMDC-UHFFFAOYSA-N
MW269.30 g/mol
LogP3.14
Rot. Bonds3

About 5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one

5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one (PubChem CID 82367269) has the molecular formula C16H15NO3 and a molecular weight of 269.30 g/mol. Its IUPAC name is 5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one
PubChem CID82367269
Molecular FormulaC16H15NO3
Molecular Weight269.30 g/mol
Exact Mass269.11
IUPAC Name5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one
SMILESCOc1ccc(-c2ccc(C3CNC(=O)O3)cc2)cc1
InChIInChI=1S/C16H15NO3/c1-19-14-8-6-12(7-9-14)11-2-4-13(5-3-11)15-10-17-16(18)20-15/h2-9,15H,10H2,1H3,(H,17,18)
InChIKeyNGXUCKOKBYWMDC-UHFFFAOYSA-N
XLogP3.14
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.30
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one?
The IUPAC name of 5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one (CID 82367269) is 5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one?
The canonical SMILES for 5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one is COc1ccc(-c2ccc(C3CNC(=O)O3)cc2)cc1.
What is the InChIKey of 5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one?
The InChIKey is NGXUCKOKBYWMDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15NO3/c1-19-14-8-6-12(7-9-14)11-2-4-13(5-3-11)15-10-17-16(18)20-15/h2-9,15H,10H2,1H3,(H,17,18).
What are the key properties of 5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one?
5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one has a molecular weight of 269.30 g/mol, XLogP of 3.14, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(4-methoxyphenyl)phenyl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 82367269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).