2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone

C14H20N2O3 — CID 84598215

IUPAC2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone
SMILESCCC(C)OCC(=O)N1CCOc2nc(C)ccc21
InChIInChI=1S/C14H20N2O3/c1-4-11(3)19-9-13(17)16-7-8-18-14-12(16)6-5-10(2)15-14/h5-6,11H,4,7-9H2,1-3H3
InChIKeyAFDORNOTVQUHAO-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.93
Rot. Bonds4

About 2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone

2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone (PubChem CID 84598215) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is 2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone.

Molecular Properties

Compound Name2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone
PubChem CID84598215
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC Name2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone
SMILESCCC(C)OCC(=O)N1CCOc2nc(C)ccc21
InChIInChI=1S/C14H20N2O3/c1-4-11(3)19-9-13(17)16-7-8-18-14-12(16)6-5-10(2)15-14/h5-6,11H,4,7-9H2,1-3H3
InChIKeyAFDORNOTVQUHAO-UHFFFAOYSA-N
XLogP1.93
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone?
The IUPAC name of 2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone (CID 84598215) is 2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone.
What is the SMILES notation for 2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone?
The canonical SMILES for 2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone is CCC(C)OCC(=O)N1CCOc2nc(C)ccc21.
What is the InChIKey of 2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone?
The InChIKey is AFDORNOTVQUHAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c1-4-11(3)19-9-13(17)16-7-8-18-14-12(16)6-5-10(2)15-14/h5-6,11H,4,7-9H2,1-3H3.
What are the key properties of 2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone?
2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone has a molecular weight of 264.32 g/mol, XLogP of 1.93, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yloxy-1-(6-methyl-2,3-dihydropyrido[2,3-b][1,4]oxazin-1-yl)ethanone is sourced from PubChem (CID 84598215), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).