4-benzyl-6-phenyl-1,4-oxazin-3-one

C17H15NO2 — CID 24980405

IUPAC4-benzyl-6-phenyl-1,4-oxazin-3-one
SMILESO=C1COC(c2ccccc2)=CN1Cc1ccccc1
InChIInChI=1S/C17H15NO2/c19-17-13-20-16(15-9-5-2-6-10-15)12-18(17)11-14-7-3-1-4-8-14/h1-10,12H,11,13H2
InChIKeyBHLAVYVXOSECKU-UHFFFAOYSA-N
MW265.31 g/mol
LogP3.04
Rot. Bonds3

About 4-benzyl-6-phenyl-1,4-oxazin-3-one

4-benzyl-6-phenyl-1,4-oxazin-3-one (PubChem CID 24980405) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is 4-benzyl-6-phenyl-1,4-oxazin-3-one.

Molecular Properties

Compound Name4-benzyl-6-phenyl-1,4-oxazin-3-one
PubChem CID24980405
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Name4-benzyl-6-phenyl-1,4-oxazin-3-one
SMILESO=C1COC(c2ccccc2)=CN1Cc1ccccc1
InChIInChI=1S/C17H15NO2/c19-17-13-20-16(15-9-5-2-6-10-15)12-18(17)11-14-7-3-1-4-8-14/h1-10,12H,11,13H2
InChIKeyBHLAVYVXOSECKU-UHFFFAOYSA-N
XLogP3.04
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 53.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-benzyl-6-phenyl-1,4-oxazin-3-one?
The IUPAC name of 4-benzyl-6-phenyl-1,4-oxazin-3-one (CID 24980405) is 4-benzyl-6-phenyl-1,4-oxazin-3-one.
What is the SMILES notation for 4-benzyl-6-phenyl-1,4-oxazin-3-one?
The canonical SMILES for 4-benzyl-6-phenyl-1,4-oxazin-3-one is O=C1COC(c2ccccc2)=CN1Cc1ccccc1.
What is the InChIKey of 4-benzyl-6-phenyl-1,4-oxazin-3-one?
The InChIKey is BHLAVYVXOSECKU-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c19-17-13-20-16(15-9-5-2-6-10-15)12-18(17)11-14-7-3-1-4-8-14/h1-10,12H,11,13H2.
What are the key properties of 4-benzyl-6-phenyl-1,4-oxazin-3-one?
4-benzyl-6-phenyl-1,4-oxazin-3-one has a molecular weight of 265.31 g/mol, XLogP of 3.04, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-benzyl-6-phenyl-1,4-oxazin-3-one is sourced from PubChem (CID 24980405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).