4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one

C18H15NO3 — CID 921407

IUPAC4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one
SMILESCOc1ccc(-c2cc(=O)oc(-c3cccc(C)c3)n2)cc1
InChIInChI=1S/C18H15NO3/c1-12-4-3-5-14(10-12)18-19-16(11-17(20)22-18)13-6-8-15(21-2)9-7-13/h3-11H,1-2H3
InChIKeyCCNBWGCKWLVCEM-UHFFFAOYSA-N
MW293.32 g/mol
LogP3.69
Rot. Bonds3

About 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one

4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one (PubChem CID 921407) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one.

Molecular Properties

Compound Name4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one
PubChem CID921407
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Name4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one
SMILESCOc1ccc(-c2cc(=O)oc(-c3cccc(C)c3)n2)cc1
InChIInChI=1S/C18H15NO3/c1-12-4-3-5-14(10-12)18-19-16(11-17(20)22-18)13-6-8-15(21-2)9-7-13/h3-11H,1-2H3
InChIKeyCCNBWGCKWLVCEM-UHFFFAOYSA-N
XLogP3.69
TPSA52.33 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 53.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one?
The IUPAC name of 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one (CID 921407) is 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one.
What is the SMILES notation for 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one?
The canonical SMILES for 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one is COc1ccc(-c2cc(=O)oc(-c3cccc(C)c3)n2)cc1.
What is the InChIKey of 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one?
The InChIKey is CCNBWGCKWLVCEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c1-12-4-3-5-14(10-12)18-19-16(11-17(20)22-18)13-6-8-15(21-2)9-7-13/h3-11H,1-2H3.
What are the key properties of 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one?
4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one has a molecular weight of 293.32 g/mol, XLogP of 3.69, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-methoxyphenyl)-2-(3-methylphenyl)-1,3-oxazin-6-one is sourced from PubChem (CID 921407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).