3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one

C17H23N3O4 — CID 129328263

About 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one

3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one (PubChem CID 129328263) has the molecular formula C17H23N3O4 and a molecular weight of 333.39 g/mol. Its IUPAC name is 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one.

Molecular Properties

• Compound Name: 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one
• PubChem CID: 129328263
• Molecular Formula: C17H23N3O4
• Molecular Weight: 333.39 g/mol
• Exact Mass: 333.17
• IUPAC Name: 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one
• SMILES: Cc1ccc(CCC(=O)N2CCO[C@H](c3nnc(C(C)C)o3)C2)o1
• InChI: InChI=1S/C17H23N3O4/c1-11(2)16-18-19-17(24-16)14-10-20(8-9-22-14)15(21)7-6-13-5-4-12(3)23-13/h4-5,11,14H,6-10H2,1-3H3/t14-/m0/s1
• InChIKey: YWNBIZYCGCZQRF-AWEZNQCLSA-N
• XLogP: 2.63
• TPSA: 81.60 Ų
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 24
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	333.39
LogP ≤ 5	2.63
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one?

The IUPAC name of 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one (CID 129328263) is 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one.

What is the SMILES notation for 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one?

The canonical SMILES for 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one is Cc1ccc(CCC(=O)N2CCO[C@H](c3nnc(C(C)C)o3)C2)o1.

What is the InChIKey of 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one?

The InChIKey is YWNBIZYCGCZQRF-AWEZNQCLSA-N. The full InChI is InChI=1S/C17H23N3O4/c1-11(2)16-18-19-17(24-16)14-10-20(8-9-22-14)15(21)7-6-13-5-4-12(3)23-13/h4-5,11,14H,6-10H2,1-3H3/t14-/m0/s1.

What are the key properties of 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one?

3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one has a molecular weight of 333.39 g/mol, XLogP of 2.63, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 3-(5-methylfuran-2-yl)-1-[(2S)-2-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)morpholin-4-yl]propan-1-one is sourced from PubChem (CID 129328263), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).