2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone

C18H15N3O4 — CID 66936639

IUPAC2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone
SMILESO=C(c1cc(OCc2ccccc2)no1)N1CCOc2ccncc21
InChIInChI=1S/C18H15N3O4/c22-18(21-8-9-23-15-6-7-19-11-14(15)21)16-10-17(20-25-16)24-12-13-4-2-1-3-5-13/h1-7,10-11H,8-9,12H2
InChIKeyOFBZCALUCCESRE-UHFFFAOYSA-N
MW337.34 g/mol
LogP2.69
Rot. Bonds4

About 2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone

2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone (PubChem CID 66936639) has the molecular formula C18H15N3O4 and a molecular weight of 337.34 g/mol. Its IUPAC name is 2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone.

Molecular Properties

Compound Name2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone
PubChem CID66936639
Molecular FormulaC18H15N3O4
Molecular Weight337.34 g/mol
Exact Mass337.11
IUPAC Name2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone
SMILESO=C(c1cc(OCc2ccccc2)no1)N1CCOc2ccncc21
InChIInChI=1S/C18H15N3O4/c22-18(21-8-9-23-15-6-7-19-11-14(15)21)16-10-17(20-25-16)24-12-13-4-2-1-3-5-13/h1-7,10-11H,8-9,12H2
InChIKeyOFBZCALUCCESRE-UHFFFAOYSA-N
XLogP2.69
TPSA77.69 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.34
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone?
The IUPAC name of 2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone (CID 66936639) is 2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone.
What is the SMILES notation for 2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone?
The canonical SMILES for 2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone is O=C(c1cc(OCc2ccccc2)no1)N1CCOc2ccncc21.
What is the InChIKey of 2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone?
The InChIKey is OFBZCALUCCESRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15N3O4/c22-18(21-8-9-23-15-6-7-19-11-14(15)21)16-10-17(20-25-16)24-12-13-4-2-1-3-5-13/h1-7,10-11H,8-9,12H2.
What are the key properties of 2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone?
2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone has a molecular weight of 337.34 g/mol, XLogP of 2.69, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydropyrido[4,3-b][1,4]oxazin-4-yl-(3-phenylmethoxy-1,2-oxazol-5-yl)methanone is sourced from PubChem (CID 66936639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).