(3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone

C19H24N4O4 — CID 124913132

About (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone

(3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone (PubChem CID 124913132) has the molecular formula C19H24N4O4 and a molecular weight of 372.43 g/mol. Its IUPAC name is (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone.

Molecular Properties

• Compound Name: (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone
• PubChem CID: 124913132
• Molecular Formula: C19H24N4O4
• Molecular Weight: 372.43 g/mol
• Exact Mass: 372.18
• IUPAC Name: (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone
• SMILES: Cc1cc(C(=O)N2CC3(C[C@@H](CCOc4cncc(C)n4)CCO3)C2)on1
• InChI: InChI=1S/C19H24N4O4/c1-13-7-16(27-22-13)18(24)23-11-19(12-23)8-15(4-6-26-19)3-5-25-17-10-20-9-14(2)21-17/h7,9-10,15H,3-6,8,11-12H2,1-2H3/t15-/m0/s1
• InChIKey: HWDBYZPGANDFEE-HNNXBMFYSA-N
• XLogP: 2.17
• TPSA: 90.58 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	372.43
LogP ≤ 5	2.17
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone?

The IUPAC name of (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone (CID 124913132) is (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone.

What is the SMILES notation for (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone?

The canonical SMILES for (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone is Cc1cc(C(=O)N2CC3(C[C@@H](CCOc4cncc(C)n4)CCO3)C2)on1.

What is the InChIKey of (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone?

The InChIKey is HWDBYZPGANDFEE-HNNXBMFYSA-N. The full InChI is InChI=1S/C19H24N4O4/c1-13-7-16(27-22-13)18(24)23-11-19(12-23)8-15(4-6-26-19)3-5-25-17-10-20-9-14(2)21-17/h7,9-10,15H,3-6,8,11-12H2,1-2H3/t15-/m0/s1.

What are the key properties of (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone?

(3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone has a molecular weight of 372.43 g/mol, XLogP of 2.17, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for (3-methyl-1,2-oxazol-5-yl)-[(8R)-8-[2-(6-methylpyrazin-2-yl)oxyethyl]-5-oxa-2-azaspiro[3.5]nonan-2-yl]methanone is sourced from PubChem (CID 124913132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).