2-ethoxy-3,4-dihydro-2H-1,3-oxazine

C6H11NO2 — CID 150383494

IUPAC2-ethoxy-3,4-dihydro-2H-1,3-oxazine
SMILESCCOC1NCC=CO1
InChIInChI=1S/C6H11NO2/c1-2-8-6-7-4-3-5-9-6/h3,5-7H,2,4H2,1H3
InChIKeyHAFKMFCVOOJYMF-UHFFFAOYSA-N
MW129.16 g/mol
LogP0.44
Rot. Bonds2

About 2-ethoxy-3,4-dihydro-2H-1,3-oxazine

2-ethoxy-3,4-dihydro-2H-1,3-oxazine (PubChem CID 150383494) has the molecular formula C6H11NO2 and a molecular weight of 129.16 g/mol. Its IUPAC name is 2-ethoxy-3,4-dihydro-2H-1,3-oxazine.

Molecular Properties

Compound Name2-ethoxy-3,4-dihydro-2H-1,3-oxazine
PubChem CID150383494
Molecular FormulaC6H11NO2
Molecular Weight129.16 g/mol
Exact Mass129.08
IUPAC Name2-ethoxy-3,4-dihydro-2H-1,3-oxazine
SMILESCCOC1NCC=CO1
InChIInChI=1S/C6H11NO2/c1-2-8-6-7-4-3-5-9-6/h3,5-7H,2,4H2,1H3
InChIKeyHAFKMFCVOOJYMF-UHFFFAOYSA-N
XLogP0.44
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.16
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-2H-oxete
CID 175705413
(2S)-2-ethoxyazetidine
CID 134536808
(3S)-3-ethoxy-2-methyl-3,4-dihydro-2H-pyran-4-ol
CID 143821584
(2R,4R)-4-ethoxy-2-methylpiperidine
CID 89400103
CID 139250229
CID 139250229
(1S,2R,4S,5S)-1,2,3,4,5-pentaethoxycyclohexane
CID 118346921
3,4-diethoxyoxolane
CID 14307969
3-ethoxyazetidine
CID 22507733
2-pentoxy-3,4-dihydro-2H-pyran
CID 67741982
3,4-diethoxydioxetane
CID 59986645
(2R,3S)-2,3-diethoxyoxirane
CID 10701862
(2S,3S,5S,6R)-4-ethoxy-3,5-dimethoxy-2,6-dimethyloxane
CID 163737733

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-3,4-dihydro-2H-1,3-oxazine?
The IUPAC name of 2-ethoxy-3,4-dihydro-2H-1,3-oxazine (CID 150383494) is 2-ethoxy-3,4-dihydro-2H-1,3-oxazine.
What is the SMILES notation for 2-ethoxy-3,4-dihydro-2H-1,3-oxazine?
The canonical SMILES for 2-ethoxy-3,4-dihydro-2H-1,3-oxazine is CCOC1NCC=CO1.
What is the InChIKey of 2-ethoxy-3,4-dihydro-2H-1,3-oxazine?
The InChIKey is HAFKMFCVOOJYMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11NO2/c1-2-8-6-7-4-3-5-9-6/h3,5-7H,2,4H2,1H3.
What are the key properties of 2-ethoxy-3,4-dihydro-2H-1,3-oxazine?
2-ethoxy-3,4-dihydro-2H-1,3-oxazine has a molecular weight of 129.16 g/mol, XLogP of 0.44, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-3,4-dihydro-2H-1,3-oxazine is sourced from PubChem (CID 150383494), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).