4-ethyl-2,6-dimethyl-4H-1,3-oxazine

C8H13NO — CID 91242441

IUPAC4-ethyl-2,6-dimethyl-4H-1,3-oxazine
SMILESCCC1C=C(C)OC(C)=N1
InChIInChI=1S/C8H13NO/c1-4-8-5-6(2)10-7(3)9-8/h5,8H,4H2,1-3H3
InChIKeyWHBGHAOCHWWRHU-UHFFFAOYSA-N
MW139.20 g/mol
LogP2.12
Rot. Bonds1

About 4-ethyl-2,6-dimethyl-4H-1,3-oxazine

4-ethyl-2,6-dimethyl-4H-1,3-oxazine (PubChem CID 91242441) has the molecular formula C8H13NO and a molecular weight of 139.20 g/mol. Its IUPAC name is 4-ethyl-2,6-dimethyl-4H-1,3-oxazine.

Molecular Properties

Compound Name4-ethyl-2,6-dimethyl-4H-1,3-oxazine
PubChem CID91242441
Molecular FormulaC8H13NO
Molecular Weight139.20 g/mol
Exact Mass139.10
IUPAC Name4-ethyl-2,6-dimethyl-4H-1,3-oxazine
SMILESCCC1C=C(C)OC(C)=N1
InChIInChI=1S/C8H13NO/c1-4-8-5-6(2)10-7(3)9-8/h5,8H,4H2,1-3H3
InChIKeyWHBGHAOCHWWRHU-UHFFFAOYSA-N
XLogP2.12
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.20
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,4,4,6-tetramethyl-4H-1,3-oxazine
CID 24978409
(4S)-6-(fluoromethyl)-2,4-dimethyl-4H-1,3-oxazine
CID 144465076
4,6-dimethyl-2-propan-2-yl-4H-1,3-oxazine
CID 91016798
6-ethyl-2,4-dimethyl-4H-1,3-oxazine
CID 144465049
[(E)-pent-2-en-2-yl] N-methylethanimidate
CID 164574589
2,6-dimethyl-N-propan-2-ylpyran-4-imine
CID 21823176

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-2,6-dimethyl-4H-1,3-oxazine?
The IUPAC name of 4-ethyl-2,6-dimethyl-4H-1,3-oxazine (CID 91242441) is 4-ethyl-2,6-dimethyl-4H-1,3-oxazine.
What is the SMILES notation for 4-ethyl-2,6-dimethyl-4H-1,3-oxazine?
The canonical SMILES for 4-ethyl-2,6-dimethyl-4H-1,3-oxazine is CCC1C=C(C)OC(C)=N1.
What is the InChIKey of 4-ethyl-2,6-dimethyl-4H-1,3-oxazine?
The InChIKey is WHBGHAOCHWWRHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13NO/c1-4-8-5-6(2)10-7(3)9-8/h5,8H,4H2,1-3H3.
What are the key properties of 4-ethyl-2,6-dimethyl-4H-1,3-oxazine?
4-ethyl-2,6-dimethyl-4H-1,3-oxazine has a molecular weight of 139.20 g/mol, XLogP of 2.12, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-2,6-dimethyl-4H-1,3-oxazine is sourced from PubChem (CID 91242441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).