6-methyl-3-phenyl-5,6-dihydro-4H-oxazine

C11H13NO — CID 54776249

IUPAC6-methyl-3-phenyl-5,6-dihydro-4H-oxazine
SMILESCC1CCC(c2ccccc2)=NO1
InChIInChI=1S/C11H13NO/c1-9-7-8-11(12-13-9)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3
InChIKeyZUHIEJZDQAVJRM-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.59
Rot. Bonds1

About 6-methyl-3-phenyl-5,6-dihydro-4H-oxazine

6-methyl-3-phenyl-5,6-dihydro-4H-oxazine (PubChem CID 54776249) has the molecular formula C11H13NO and a molecular weight of 175.23 g/mol. Its IUPAC name is 6-methyl-3-phenyl-5,6-dihydro-4H-oxazine.

Molecular Properties

Compound Name6-methyl-3-phenyl-5,6-dihydro-4H-oxazine
PubChem CID54776249
Molecular FormulaC11H13NO
Molecular Weight175.23 g/mol
Exact Mass175.10
IUPAC Name6-methyl-3-phenyl-5,6-dihydro-4H-oxazine
SMILESCC1CCC(c2ccccc2)=NO1
InChIInChI=1S/C11H13NO/c1-9-7-8-11(12-13-9)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3
InChIKeyZUHIEJZDQAVJRM-UHFFFAOYSA-N
XLogP2.59
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.59
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-methyl-3-phenyl-5,6-dihydro-4H-oxazine?
The IUPAC name of 6-methyl-3-phenyl-5,6-dihydro-4H-oxazine (CID 54776249) is 6-methyl-3-phenyl-5,6-dihydro-4H-oxazine.
What is the SMILES notation for 6-methyl-3-phenyl-5,6-dihydro-4H-oxazine?
The canonical SMILES for 6-methyl-3-phenyl-5,6-dihydro-4H-oxazine is CC1CCC(c2ccccc2)=NO1.
What is the InChIKey of 6-methyl-3-phenyl-5,6-dihydro-4H-oxazine?
The InChIKey is ZUHIEJZDQAVJRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13NO/c1-9-7-8-11(12-13-9)10-5-3-2-4-6-10/h2-6,9H,7-8H2,1H3.
What are the key properties of 6-methyl-3-phenyl-5,6-dihydro-4H-oxazine?
6-methyl-3-phenyl-5,6-dihydro-4H-oxazine has a molecular weight of 175.23 g/mol, XLogP of 2.59, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-3-phenyl-5,6-dihydro-4H-oxazine is sourced from PubChem (CID 54776249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).