1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one

C15H20N2O3 — CID 164637339

IUPAC1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one
SMILESO=C(CC[C@H]1CCCCO1)N1CCOc2ccncc21
InChIInChI=1S/C15H20N2O3/c18-15(5-4-12-3-1-2-9-19-12)17-8-10-20-14-6-7-16-11-13(14)17/h6-7,11-12H,1-5,8-10H2/t12-/m1/s1
InChIKeyVIEVPAAAZSGGSI-GFCCVEGCSA-N
MW276.34 g/mol
LogP2.16
Rot. Bonds3

About 1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one

1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one (PubChem CID 164637339) has the molecular formula C15H20N2O3 and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one.

Molecular Properties

Compound Name1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one
PubChem CID164637339
Molecular FormulaC15H20N2O3
Molecular Weight276.34 g/mol
Exact Mass276.15
IUPAC Name1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one
SMILESO=C(CC[C@H]1CCCCO1)N1CCOc2ccncc21
InChIInChI=1S/C15H20N2O3/c18-15(5-4-12-3-1-2-9-19-12)17-8-10-20-14-6-7-16-11-13(14)17/h6-7,11-12H,1-5,8-10H2/t12-/m1/s1
InChIKeyVIEVPAAAZSGGSI-GFCCVEGCSA-N
XLogP2.16
TPSA51.66 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one?
The IUPAC name of 1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one (CID 164637339) is 1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one.
What is the SMILES notation for 1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one?
The canonical SMILES for 1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one is O=C(CC[C@H]1CCCCO1)N1CCOc2ccncc21.
What is the InChIKey of 1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one?
The InChIKey is VIEVPAAAZSGGSI-GFCCVEGCSA-N. The full InChI is InChI=1S/C15H20N2O3/c18-15(5-4-12-3-1-2-9-19-12)17-8-10-20-14-6-7-16-11-13(14)17/h6-7,11-12H,1-5,8-10H2/t12-/m1/s1.
What are the key properties of 1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one?
1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one has a molecular weight of 276.34 g/mol, XLogP of 2.16, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)-3-[(2R)-oxan-2-yl]propan-1-one is sourced from PubChem (CID 164637339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).