1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone

C22H27N5O3 — CID 46385196

About 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone

1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone (PubChem CID 46385196) has the molecular formula C22H27N5O3 and a molecular weight of 409.49 g/mol. Its IUPAC name is 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone.

Molecular Properties

• Compound Name: 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone
• PubChem CID: 46385196
• Molecular Formula: C22H27N5O3
• Molecular Weight: 409.49 g/mol
• Exact Mass: 409.21
• IUPAC Name: 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone
• SMILES: O=C(Cn1cc(-c2nnc(CN3CCCCC3)o2)c2ccccc21)N1CCOCC1
• InChI: InChI=1S/C22H27N5O3/c28-21(26-10-12-29-13-11-26)16-27-14-18(17-6-2-3-7-19(17)27)22-24-23-20(30-22)15-25-8-4-1-5-9-25/h2-3,6-7,14H,1,4-5,8-13,15-16H2
• InChIKey: IUQGQTQPZXPBLJ-UHFFFAOYSA-N
• XLogP: 2.54
• TPSA: 76.63 Ų
• H-Bond Acceptors: 7
• Rotatable Bonds: 5
• Heavy Atoms: 30
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	409.49
LogP ≤ 5	2.54
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone?

The IUPAC name of 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone (CID 46385196) is 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone.

What is the SMILES notation for 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone?

The canonical SMILES for 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone is O=C(Cn1cc(-c2nnc(CN3CCCCC3)o2)c2ccccc21)N1CCOCC1.

What is the InChIKey of 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone?

The InChIKey is IUQGQTQPZXPBLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H27N5O3/c28-21(26-10-12-29-13-11-26)16-27-14-18(17-6-2-3-7-19(17)27)22-24-23-20(30-22)15-25-8-4-1-5-9-25/h2-3,6-7,14H,1,4-5,8-13,15-16H2.

What are the key properties of 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone?

1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone has a molecular weight of 409.49 g/mol, XLogP of 2.54, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for 1-morpholin-4-yl-2-[3-[5-(piperidin-1-ylmethyl)-1,3,4-oxadiazol-2-yl]indol-1-yl]ethanone is sourced from PubChem (CID 46385196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).