N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide

C20H23N5O2S — CID 55516747

About N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide

N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide (PubChem CID 55516747) has the molecular formula C20H23N5O2S and a molecular weight of 397.50 g/mol. Its IUPAC name is N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide.

Molecular Properties

• Compound Name: N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide
• PubChem CID: 55516747
• Molecular Formula: C20H23N5O2S
• Molecular Weight: 397.50 g/mol
• Exact Mass: 397.16
• IUPAC Name: N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide
• SMILES: CC(c1nnc(-c2cccs2)o1)N1CCN(CC(=O)Nc2ccccc2)CC1
• InChI: InChI=1S/C20H23N5O2S/c1-15(19-22-23-20(27-19)17-8-5-13-28-17)25-11-9-24(10-12-25)14-18(26)21-16-6-3-2-4-7-16/h2-8,13,15H,9-12,14H2,1H3,(H,21,26)
• InChIKey: FRGIVWDHPQSEDD-UHFFFAOYSA-N
• XLogP: 3.12
• TPSA: 74.50 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 7
• Rotatable Bonds: 6
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	397.50
LogP ≤ 5	3.12
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	7

Frequently Asked Questions

What is the IUPAC name of N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide?

The IUPAC name of N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide (CID 55516747) is N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide.

What is the SMILES notation for N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide?

The canonical SMILES for N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide is CC(c1nnc(-c2cccs2)o1)N1CCN(CC(=O)Nc2ccccc2)CC1.

What is the InChIKey of N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide?

The InChIKey is FRGIVWDHPQSEDD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N5O2S/c1-15(19-22-23-20(27-19)17-8-5-13-28-17)25-11-9-24(10-12-25)14-18(26)21-16-6-3-2-4-7-16/h2-8,13,15H,9-12,14H2,1H3,(H,21,26).

What are the key properties of N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide?

N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide has a molecular weight of 397.50 g/mol, XLogP of 3.12, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.

Where does this data come from?

All data for N-phenyl-2-[4-[1-(5-thiophen-2-yl-1,3,4-oxadiazol-2-yl)ethyl]piperazin-1-yl]acetamide is sourced from PubChem (CID 55516747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).