2,4,6-trimethyl-2,3-dihydro-1,4-oxazine

C7H13NO — CID 19862111

IUPAC2,4,6-trimethyl-2,3-dihydro-1,4-oxazine
SMILESCC1=CN(C)CC(C)O1
InChIInChI=1S/C7H13NO/c1-6-4-8(3)5-7(2)9-6/h4,7H,5H2,1-3H3
InChIKeyGMKJECGIARQABX-UHFFFAOYSA-N
MW127.19 g/mol
LogP1.20
Rot. Bonds

About 2,4,6-trimethyl-2,3-dihydro-1,4-oxazine

2,4,6-trimethyl-2,3-dihydro-1,4-oxazine (PubChem CID 19862111) has the molecular formula C7H13NO and a molecular weight of 127.19 g/mol. Its IUPAC name is 2,4,6-trimethyl-2,3-dihydro-1,4-oxazine.

Molecular Properties

Compound Name2,4,6-trimethyl-2,3-dihydro-1,4-oxazine
PubChem CID19862111
Molecular FormulaC7H13NO
Molecular Weight127.19 g/mol
Exact Mass127.10
IUPAC Name2,4,6-trimethyl-2,3-dihydro-1,4-oxazine
SMILESCC1=CN(C)CC(C)O1
InChIInChI=1S/C7H13NO/c1-6-4-8(3)5-7(2)9-6/h4,7H,5H2,1-3H3
InChIKeyGMKJECGIARQABX-UHFFFAOYSA-N
XLogP1.20
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.19
LogP ≤ 51.20
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,4,6-trimethyl-2,3-dihydro-1,4-oxazine?
The IUPAC name of 2,4,6-trimethyl-2,3-dihydro-1,4-oxazine (CID 19862111) is 2,4,6-trimethyl-2,3-dihydro-1,4-oxazine.
What is the SMILES notation for 2,4,6-trimethyl-2,3-dihydro-1,4-oxazine?
The canonical SMILES for 2,4,6-trimethyl-2,3-dihydro-1,4-oxazine is CC1=CN(C)CC(C)O1.
What is the InChIKey of 2,4,6-trimethyl-2,3-dihydro-1,4-oxazine?
The InChIKey is GMKJECGIARQABX-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO/c1-6-4-8(3)5-7(2)9-6/h4,7H,5H2,1-3H3.
What are the key properties of 2,4,6-trimethyl-2,3-dihydro-1,4-oxazine?
2,4,6-trimethyl-2,3-dihydro-1,4-oxazine has a molecular weight of 127.19 g/mol, XLogP of 1.20, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4,6-trimethyl-2,3-dihydro-1,4-oxazine is sourced from PubChem (CID 19862111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).