5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine

C18H20N2O2 — CID 71683044

IUPAC5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine
SMILESCOc1cccc(-c2cccc(C3(C)COCC(N)=N3)c2)c1
InChIInChI=1S/C18H20N2O2/c1-18(12-22-11-17(19)20-18)15-7-3-5-13(9-15)14-6-4-8-16(10-14)21-2/h3-10H,11-12H2,1-2H3,(H2,19,20)
InChIKeyUJJUBYHHIWOWQJ-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.96
Rot. Bonds3

About 5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine

5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine (PubChem CID 71683044) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine.

Molecular Properties

Compound Name5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine
PubChem CID71683044
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine
SMILESCOc1cccc(-c2cccc(C3(C)COCC(N)=N3)c2)c1
InChIInChI=1S/C18H20N2O2/c1-18(12-22-11-17(19)20-18)15-7-3-5-13(9-15)14-6-4-8-16(10-14)21-2/h3-10H,11-12H2,1-2H3,(H2,19,20)
InChIKeyUJJUBYHHIWOWQJ-UHFFFAOYSA-N
XLogP2.96
TPSA56.84 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine 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-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine?
The IUPAC name of 5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine (CID 71683044) is 5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine.
What is the SMILES notation for 5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine?
The canonical SMILES for 5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine is COc1cccc(-c2cccc(C3(C)COCC(N)=N3)c2)c1.
What is the InChIKey of 5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine?
The InChIKey is UJJUBYHHIWOWQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-18(12-22-11-17(19)20-18)15-7-3-5-13(9-15)14-6-4-8-16(10-14)21-2/h3-10H,11-12H2,1-2H3,(H2,19,20).
What are the key properties of 5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine?
5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine has a molecular weight of 296.37 g/mol, XLogP of 2.96, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(3-methoxyphenyl)phenyl]-5-methyl-2,6-dihydro-1,4-oxazin-3-amine is sourced from PubChem (CID 71683044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).