4-ethyl-1,4-oxazine

C6H9NO — CID 70658841

IUPAC4-ethyl-1,4-oxazine
SMILESCCN1C=COC=C1
InChIInChI=1S/C6H9NO/c1-2-7-3-5-8-6-4-7/h3-6H,2H2,1H3
InChIKeyCRHPQDSUHLQCCB-UHFFFAOYSA-N
MW111.14 g/mol
LogP1.28
Rot. Bonds1

About 4-ethyl-1,4-oxazine

4-ethyl-1,4-oxazine (PubChem CID 70658841) has the molecular formula C6H9NO and a molecular weight of 111.14 g/mol. Its IUPAC name is 4-ethyl-1,4-oxazine.

Molecular Properties

Compound Name4-ethyl-1,4-oxazine
PubChem CID70658841
Molecular FormulaC6H9NO
Molecular Weight111.14 g/mol
Exact Mass111.07
IUPAC Name4-ethyl-1,4-oxazine
SMILESCCN1C=COC=C1
InChIInChI=1S/C6H9NO/c1-2-7-3-5-8-6-4-7/h3-6H,2H2,1H3
InChIKeyCRHPQDSUHLQCCB-UHFFFAOYSA-N
XLogP1.28
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500111.14
LogP ≤ 51.28
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2,3-dehydro-N-methylmorpholine
CID 18704486
4-Methyl-1,4-oxazine
CID 15331497
4-Ethyl-2,3-dihydro-1,4-oxazine
CID 21270543
N-methyl oxazoline
CID 19079310
N-ethyl oxazole
CID 23317920
1-ethoxy-N-ethyl-N-methylethenamine
CID 134987246
2-Fluoro-4-methyl-2,3-dihydro-1,4-oxazine
CID 174964397
2-Fluoro-4-methyl-1,4-oxazine
CID 175193944
[(Z)-2-methoxyethenyl]-trimethylazanium bromide
CID 134986601
[(Z)-2-ethoxyethenyl]-trimethylazanium bromide
CID 134986713
3-ethenyl-2H-1,3-oxazole
CID 18430596
3,3-dimethyl-2H-1,3-oxazol-3-ium
CID 18431014

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-1,4-oxazine?
The IUPAC name of 4-ethyl-1,4-oxazine (CID 70658841) is 4-ethyl-1,4-oxazine.
What is the SMILES notation for 4-ethyl-1,4-oxazine?
The canonical SMILES for 4-ethyl-1,4-oxazine is CCN1C=COC=C1.
What is the InChIKey of 4-ethyl-1,4-oxazine?
The InChIKey is CRHPQDSUHLQCCB-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9NO/c1-2-7-3-5-8-6-4-7/h3-6H,2H2,1H3.
What are the key properties of 4-ethyl-1,4-oxazine?
4-ethyl-1,4-oxazine has a molecular weight of 111.14 g/mol, XLogP of 1.28, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-1,4-oxazine is sourced from PubChem (CID 70658841), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).