2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide

C16H12N2O3 — CID 162656722

IUPAC2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide
SMILESO=C(Nc1ccccc1)n1cc(-c2ccccc2)oc1=O
InChIInChI=1S/C16H12N2O3/c19-15(17-13-9-5-2-6-10-13)18-11-14(21-16(18)20)12-7-3-1-4-8-12/h1-11H,(H,17,19)
InChIKeyGIPZFJQFDKMBPV-UHFFFAOYSA-N
MW280.28 g/mol
LogP3.19
Rot. Bonds2

About 2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide

2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide (PubChem CID 162656722) has the molecular formula C16H12N2O3 and a molecular weight of 280.28 g/mol. Its IUPAC name is 2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide.

Molecular Properties

Compound Name2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide
PubChem CID162656722
Molecular FormulaC16H12N2O3
Molecular Weight280.28 g/mol
Exact Mass280.08
IUPAC Name2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide
SMILESO=C(Nc1ccccc1)n1cc(-c2ccccc2)oc1=O
InChIInChI=1S/C16H12N2O3/c19-15(17-13-9-5-2-6-10-13)18-11-14(21-16(18)20)12-7-3-1-4-8-12/h1-11H,(H,17,19)
InChIKeyGIPZFJQFDKMBPV-UHFFFAOYSA-N
XLogP3.19
TPSA64.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.28
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide?
The IUPAC name of 2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide (CID 162656722) is 2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide.
What is the SMILES notation for 2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide?
The canonical SMILES for 2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide is O=C(Nc1ccccc1)n1cc(-c2ccccc2)oc1=O.
What is the InChIKey of 2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide?
The InChIKey is GIPZFJQFDKMBPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H12N2O3/c19-15(17-13-9-5-2-6-10-13)18-11-14(21-16(18)20)12-7-3-1-4-8-12/h1-11H,(H,17,19).
What are the key properties of 2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide?
2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide has a molecular weight of 280.28 g/mol, XLogP of 3.19, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-oxo-N,5-diphenyl-1,3-oxazole-3-carboxamide is sourced from PubChem (CID 162656722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).