2-ethyl-2,5-dimethyl-1,3-oxazinane

C8H17NO — CID 117226941

IUPAC2-ethyl-2,5-dimethyl-1,3-oxazinane
SMILESCCC1(C)NCC(C)CO1
InChIInChI=1S/C8H17NO/c1-4-8(3)9-5-7(2)6-10-8/h7,9H,4-6H2,1-3H3
InChIKeyUFLMXUPCYRGRNB-UHFFFAOYSA-N
MW143.23 g/mol
LogP1.37
Rot. Bonds1

About 2-ethyl-2,5-dimethyl-1,3-oxazinane

2-ethyl-2,5-dimethyl-1,3-oxazinane (PubChem CID 117226941) has the molecular formula C8H17NO and a molecular weight of 143.23 g/mol. Its IUPAC name is 2-ethyl-2,5-dimethyl-1,3-oxazinane.

Molecular Properties

Compound Name2-ethyl-2,5-dimethyl-1,3-oxazinane
PubChem CID117226941
Molecular FormulaC8H17NO
Molecular Weight143.23 g/mol
Exact Mass143.13
IUPAC Name2-ethyl-2,5-dimethyl-1,3-oxazinane
SMILESCCC1(C)NCC(C)CO1
InChIInChI=1S/C8H17NO/c1-4-8(3)9-5-7(2)6-10-8/h7,9H,4-6H2,1-3H3
InChIKeyUFLMXUPCYRGRNB-UHFFFAOYSA-N
XLogP1.37
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500143.23
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2,5-dimethyl-1,3-oxazinane?
The IUPAC name of 2-ethyl-2,5-dimethyl-1,3-oxazinane (CID 117226941) is 2-ethyl-2,5-dimethyl-1,3-oxazinane.
What is the SMILES notation for 2-ethyl-2,5-dimethyl-1,3-oxazinane?
The canonical SMILES for 2-ethyl-2,5-dimethyl-1,3-oxazinane is CCC1(C)NCC(C)CO1.
What is the InChIKey of 2-ethyl-2,5-dimethyl-1,3-oxazinane?
The InChIKey is UFLMXUPCYRGRNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H17NO/c1-4-8(3)9-5-7(2)6-10-8/h7,9H,4-6H2,1-3H3.
What are the key properties of 2-ethyl-2,5-dimethyl-1,3-oxazinane?
2-ethyl-2,5-dimethyl-1,3-oxazinane has a molecular weight of 143.23 g/mol, XLogP of 1.37, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2,5-dimethyl-1,3-oxazinane is sourced from PubChem (CID 117226941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).