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

C15H18N2O2 — CID 71976705

IUPAC2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone
SMILESO=C(CC1=CCCCC1)N1CCOc2ccncc21
InChIInChI=1S/C15H18N2O2/c18-15(10-12-4-2-1-3-5-12)17-8-9-19-14-6-7-16-11-13(14)17/h4,6-7,11H,1-3,5,8-10H2
InChIKeyXASUQERVJZPQPF-UHFFFAOYSA-N
MW258.32 g/mol
LogP2.70
Rot. Bonds2

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

2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone (PubChem CID 71976705) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is 2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone.

Molecular Properties

Compound Name2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone
PubChem CID71976705
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC Name2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone
SMILESO=C(CC1=CCCCC1)N1CCOc2ccncc21
InChIInChI=1S/C15H18N2O2/c18-15(10-12-4-2-1-3-5-12)17-8-9-19-14-6-7-16-11-13(14)17/h4,6-7,11H,1-3,5,8-10H2
InChIKeyXASUQERVJZPQPF-UHFFFAOYSA-N
XLogP2.70
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 52.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone?
The IUPAC name of 2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone (CID 71976705) is 2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone.
What is the SMILES notation for 2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone?
The canonical SMILES for 2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone is O=C(CC1=CCCCC1)N1CCOc2ccncc21.
What is the InChIKey of 2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone?
The InChIKey is XASUQERVJZPQPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c18-15(10-12-4-2-1-3-5-12)17-8-9-19-14-6-7-16-11-13(14)17/h4,6-7,11H,1-3,5,8-10H2.
What are the key properties of 2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone?
2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone has a molecular weight of 258.32 g/mol, XLogP of 2.70, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cyclohexen-1-yl)-1-(2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl)ethanone is sourced from PubChem (CID 71976705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).