5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine

C11H14N2O — CID 115018218

IUPAC5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine
SMILESCC1(c2ccccc2)COCC(N)=N1
InChIInChI=1S/C11H14N2O/c1-11(8-14-7-10(12)13-11)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H2,12,13)
InChIKeyDMFKETVWVKXFPB-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.29
Rot. Bonds1

About 5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine

5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine (PubChem CID 115018218) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine.

Molecular Properties

Compound Name5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine
PubChem CID115018218
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine
SMILESCC1(c2ccccc2)COCC(N)=N1
InChIInChI=1S/C11H14N2O/c1-11(8-14-7-10(12)13-11)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H2,12,13)
InChIKeyDMFKETVWVKXFPB-UHFFFAOYSA-N
XLogP1.29
TPSA47.61 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine?
The IUPAC name of 5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine (CID 115018218) is 5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine.
What is the SMILES notation for 5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine?
The canonical SMILES for 5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine is CC1(c2ccccc2)COCC(N)=N1.
What is the InChIKey of 5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine?
The InChIKey is DMFKETVWVKXFPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-11(8-14-7-10(12)13-11)9-5-3-2-4-6-9/h2-6H,7-8H2,1H3,(H2,12,13).
What are the key properties of 5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine?
5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine has a molecular weight of 190.25 g/mol, XLogP of 1.29, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-5-phenyl-2,6-dihydro-1,4-oxazin-3-amine is sourced from PubChem (CID 115018218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).