5-phenyl-3,6-dihydro-2H-1,4-oxazine

C10H11NO — CID 86009484

IUPAC5-phenyl-3,6-dihydro-2H-1,4-oxazine
SMILESc1ccc(C2=NCCOC2)cc1
InChIInChI=1S/C10H11NO/c1-2-4-9(5-3-1)10-8-12-7-6-11-10/h1-5H,6-8H2
InChIKeyMLJDVQRJUGLDBX-UHFFFAOYSA-N
MW161.20 g/mol
LogP1.51
Rot. Bonds1

About 5-phenyl-3,6-dihydro-2H-1,4-oxazine

5-phenyl-3,6-dihydro-2H-1,4-oxazine (PubChem CID 86009484) has the molecular formula C10H11NO and a molecular weight of 161.20 g/mol. Its IUPAC name is 5-phenyl-3,6-dihydro-2H-1,4-oxazine.

Molecular Properties

Compound Name5-phenyl-3,6-dihydro-2H-1,4-oxazine
PubChem CID86009484
Molecular FormulaC10H11NO
Molecular Weight161.20 g/mol
Exact Mass161.08
IUPAC Name5-phenyl-3,6-dihydro-2H-1,4-oxazine
SMILESc1ccc(C2=NCCOC2)cc1
InChIInChI=1S/C10H11NO/c1-2-4-9(5-3-1)10-8-12-7-6-11-10/h1-5H,6-8H2
InChIKeyMLJDVQRJUGLDBX-UHFFFAOYSA-N
XLogP1.51
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.20
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 5-phenyl-3,6-dihydro-2H-1,4-oxazine 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 5-phenyl-3,6-dihydro-2H-1,4-oxazine?
The IUPAC name of 5-phenyl-3,6-dihydro-2H-1,4-oxazine (CID 86009484) is 5-phenyl-3,6-dihydro-2H-1,4-oxazine.
What is the SMILES notation for 5-phenyl-3,6-dihydro-2H-1,4-oxazine?
The canonical SMILES for 5-phenyl-3,6-dihydro-2H-1,4-oxazine is c1ccc(C2=NCCOC2)cc1.
What is the InChIKey of 5-phenyl-3,6-dihydro-2H-1,4-oxazine?
The InChIKey is MLJDVQRJUGLDBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO/c1-2-4-9(5-3-1)10-8-12-7-6-11-10/h1-5H,6-8H2.
What are the key properties of 5-phenyl-3,6-dihydro-2H-1,4-oxazine?
5-phenyl-3,6-dihydro-2H-1,4-oxazine has a molecular weight of 161.20 g/mol, XLogP of 1.51, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-3,6-dihydro-2H-1,4-oxazine is sourced from PubChem (CID 86009484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).