4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine

C16H26N2O2 — CID 12072156

IUPAC4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine
SMILESCC1CC(C)(C)N=C(/C=C/C2=NC(C)(C)CC(C)O2)O1
InChIInChI=1S/C16H26N2O2/c1-11-9-15(3,4)17-13(19-11)7-8-14-18-16(5,6)10-12(2)20-14/h7-8,11-12H,9-10H2,1-6H3/b8-7+
InChIKeyUJUSYOFCWSZVBM-BQYQJAHWSA-N
MW278.40 g/mol
LogP3.51
Rot. Bonds2

About 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine

4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine (PubChem CID 12072156) has the molecular formula C16H26N2O2 and a molecular weight of 278.40 g/mol. Its IUPAC name is 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine.

Molecular Properties

Compound Name4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine
PubChem CID12072156
Molecular FormulaC16H26N2O2
Molecular Weight278.40 g/mol
Exact Mass278.20
IUPAC Name4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine
SMILESCC1CC(C)(C)N=C(/C=C/C2=NC(C)(C)CC(C)O2)O1
InChIInChI=1S/C16H26N2O2/c1-11-9-15(3,4)17-13(19-11)7-8-14-18-16(5,6)10-12(2)20-14/h7-8,11-12H,9-10H2,1-6H3/b8-7+
InChIKeyUJUSYOFCWSZVBM-BQYQJAHWSA-N
XLogP3.51
TPSA43.18 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine with MolForge

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

Launch Full Analysis

Related Compounds

5,6-Dihydro-4,4,6-trimethyl-2-vinyl-4H-1,3-oxazine
CID 90992
2-[[(E)-but-2-enoxy]methyl]-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
CID 13061355
(6S)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
CID 6931650
(6R)-2-ethenyl-4,4,6-trimethyl-5,6-dihydro-1,3-oxazine
CID 6931651

Frequently Asked Questions

What is the IUPAC name of 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine?
The IUPAC name of 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine (CID 12072156) is 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine.
What is the SMILES notation for 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine?
The canonical SMILES for 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine is CC1CC(C)(C)N=C(/C=C/C2=NC(C)(C)CC(C)O2)O1.
What is the InChIKey of 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine?
The InChIKey is UJUSYOFCWSZVBM-BQYQJAHWSA-N. The full InChI is InChI=1S/C16H26N2O2/c1-11-9-15(3,4)17-13(19-11)7-8-14-18-16(5,6)10-12(2)20-14/h7-8,11-12H,9-10H2,1-6H3/b8-7+.
What are the key properties of 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine?
4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine has a molecular weight of 278.40 g/mol, XLogP of 3.51, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4,4,6-trimethyl-2-[(E)-2-(4,4,6-trimethyl-5,6-dihydro-1,3-oxazin-2-yl)ethenyl]-5,6-dihydro-1,3-oxazine is sourced from PubChem (CID 12072156), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).