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

C12H16N2O2 — CID 166918590

IUPAC1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone
SMILESCC(=O)N1CCOc2ccc(C(C)C)nc21
InChIInChI=1S/C12H16N2O2/c1-8(2)10-4-5-11-12(13-10)14(9(3)15)6-7-16-11/h4-5,8H,6-7H2,1-3H3
InChIKeyZNJOGSYTBBRYOY-UHFFFAOYSA-N
MW220.27 g/mol
LogP1.95
Rot. Bonds1

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

1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone (PubChem CID 166918590) has the molecular formula C12H16N2O2 and a molecular weight of 220.27 g/mol. Its IUPAC name is 1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone.

Molecular Properties

Compound Name1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone
PubChem CID166918590
Molecular FormulaC12H16N2O2
Molecular Weight220.27 g/mol
Exact Mass220.12
IUPAC Name1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone
SMILESCC(=O)N1CCOc2ccc(C(C)C)nc21
InChIInChI=1S/C12H16N2O2/c1-8(2)10-4-5-11-12(13-10)14(9(3)15)6-7-16-11/h4-5,8H,6-7H2,1-3H3
InChIKeyZNJOGSYTBBRYOY-UHFFFAOYSA-N
XLogP1.95
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.27
LogP ≤ 51.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone?
The IUPAC name of 1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone (CID 166918590) is 1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone.
What is the SMILES notation for 1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone?
The canonical SMILES for 1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone is CC(=O)N1CCOc2ccc(C(C)C)nc21.
What is the InChIKey of 1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone?
The InChIKey is ZNJOGSYTBBRYOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O2/c1-8(2)10-4-5-11-12(13-10)14(9(3)15)6-7-16-11/h4-5,8H,6-7H2,1-3H3.
What are the key properties of 1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone?
1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone has a molecular weight of 220.27 g/mol, XLogP of 1.95, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-propan-2-yl-2,3-dihydropyrido[3,2-b][1,4]oxazin-4-yl)ethanone is sourced from PubChem (CID 166918590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).