2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine

C9H17NO — CID 24976693

IUPAC2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine
SMILESCCC1(C)N=CC(C)(C)CO1
InChIInChI=1S/C9H17NO/c1-5-9(4)10-6-8(2,3)7-11-9/h6H,5,7H2,1-4H3
InChIKeyULMHHDOZIUEYJW-UHFFFAOYSA-N
MW155.24 g/mol
LogP2.24
Rot. Bonds1

About 2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine

2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine (PubChem CID 24976693) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is 2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine.

Molecular Properties

Compound Name2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine
PubChem CID24976693
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC Name2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine
SMILESCCC1(C)N=CC(C)(C)CO1
InChIInChI=1S/C9H17NO/c1-5-9(4)10-6-8(2,3)7-11-9/h6H,5,7H2,1-4H3
InChIKeyULMHHDOZIUEYJW-UHFFFAOYSA-N
XLogP2.24
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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2-ethyl-2,4-dimethyl-4-prop-1-enoxy-1,3-dioxolane
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4-[(2S)-2-ethyloxiran-2-yl]pyridine
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2-ethyl-2-methyl-1,4-dioxane
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trimethyl-[(4,6,6-trimethyl-2,5-dihydropyran-3-yl)methyl]silane
CID 10262616
4-ethyl-2,6,7-trioxa-1-arsabicyclo[2.2.2]octane
CID 3051637
2-[1,1-bis(2-methyloxiran-2-yl)propyl]-2-methyloxirane
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5-ethyl-5-methyl-4H-1,3-oxazole
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3-chloro-2-ethyl-2-methyloxolane
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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine?
The IUPAC name of 2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine (CID 24976693) is 2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine.
What is the SMILES notation for 2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine?
The canonical SMILES for 2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine is CCC1(C)N=CC(C)(C)CO1.
What is the InChIKey of 2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine?
The InChIKey is ULMHHDOZIUEYJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-5-9(4)10-6-8(2,3)7-11-9/h6H,5,7H2,1-4H3.
What are the key properties of 2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine?
2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine has a molecular weight of 155.24 g/mol, XLogP of 2.24, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2,5,5-trimethyl-6H-1,3-oxazine is sourced from PubChem (CID 24976693), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).