1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone

C23H24N6O2 — CID 53134142

About 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone

1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone (PubChem CID 53134142) has the molecular formula C23H24N6O2 and a molecular weight of 416.49 g/mol. Its IUPAC name is 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone.

Molecular Properties

• Compound Name: 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone
• PubChem CID: 53134142
• Molecular Formula: C23H24N6O2
• Molecular Weight: 416.49 g/mol
• Exact Mass: 416.20
• IUPAC Name: 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone
• SMILES: CC(C)c1nnc(-c2cccnc2N2CCN(C(=O)c3ccc4[nH]ccc4c3)CC2)o1
• InChI: InChI=1S/C23H24N6O2/c1-15(2)21-26-27-22(31-21)18-4-3-8-25-20(18)28-10-12-29(13-11-28)23(30)17-5-6-19-16(14-17)7-9-24-19/h3-9,14-15,24H,10-13H2,1-2H3
• InChIKey: LXFQHZLWEOUFAA-UHFFFAOYSA-N
• XLogP: 3.70
• TPSA: 91.15 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 31
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	416.49
LogP ≤ 5	3.70
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone?

The IUPAC name of 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone (CID 53134142) is 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone.

What is the SMILES notation for 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone?

The canonical SMILES for 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone is CC(C)c1nnc(-c2cccnc2N2CCN(C(=O)c3ccc4[nH]ccc4c3)CC2)o1.

What is the InChIKey of 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone?

The InChIKey is LXFQHZLWEOUFAA-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24N6O2/c1-15(2)21-26-27-22(31-21)18-4-3-8-25-20(18)28-10-12-29(13-11-28)23(30)17-5-6-19-16(14-17)7-9-24-19/h3-9,14-15,24H,10-13H2,1-2H3.

What are the key properties of 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone?

1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone has a molecular weight of 416.49 g/mol, XLogP of 3.70, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 1H-indol-5-yl-[4-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)-2-pyridinyl]piperazin-1-yl]methanone is sourced from PubChem (CID 53134142), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).