1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone

C15H16N4O4 — CID 133139925

About 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone

1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone (PubChem CID 133139925) has the molecular formula C15H16N4O4 and a molecular weight of 316.32 g/mol. Its IUPAC name is 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone.

Molecular Properties

• Compound Name: 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone
• PubChem CID: 133139925
• Molecular Formula: C15H16N4O4
• Molecular Weight: 316.32 g/mol
• Exact Mass: 316.12
• IUPAC Name: 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone
• SMILES: O=C(c1cocn1)N1CC2(CC(Oc3cnccn3)CCO2)C1
• InChI: InChI=1S/C15H16N4O4/c20-14(12-7-21-10-18-12)19-8-15(9-19)5-11(1-4-22-15)23-13-6-16-2-3-17-13/h2-3,6-7,10-11H,1,4-5,8-9H2
• InChIKey: KQZHCNRPYPHABZ-UHFFFAOYSA-N
• XLogP: 0.92
• TPSA: 90.58 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 3
• Heavy Atoms: 23
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	316.32
LogP ≤ 5	0.92
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone?

The IUPAC name of 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone (CID 133139925) is 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone.

What is the SMILES notation for 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone?

The canonical SMILES for 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone is O=C(c1cocn1)N1CC2(CC(Oc3cnccn3)CCO2)C1.

What is the InChIKey of 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone?

The InChIKey is KQZHCNRPYPHABZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O4/c20-14(12-7-21-10-18-12)19-8-15(9-19)5-11(1-4-22-15)23-13-6-16-2-3-17-13/h2-3,6-7,10-11H,1,4-5,8-9H2.

What are the key properties of 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone?

1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone has a molecular weight of 316.32 g/mol, XLogP of 0.92, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1,3-oxazol-4-yl-(8-pyrazin-2-yloxy-5-oxa-2-azaspiro[3.5]nonan-2-yl)methanone is sourced from PubChem (CID 133139925), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).