2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide

C₁₉H₁₉F₂N₃O₂ — CID 15999180

About 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide

2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide (PubChem CID 15999180) has the molecular formula C₁₉H₁₉F₂N₃O₂ and a molecular weight of 359.38 g/mol. Its IUPAC name is 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide.

Molecular Properties

• Compound Name: 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide
• PubChem CID: 15999180
• Molecular Formula: C₁₉H₁₉F₂N₃O₂
• Molecular Weight: 359.38 g/mol
• Exact Mass: 359.14
• IUPAC Name: 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide
• SMILES: O=C(CN1CCN(C(=O)c2ccccc2F)CC1)Nc1ccccc1F
• InChI: InChI=1S/C19H19F2N3O2/c20-15-6-2-1-5-14(15)19(26)24-11-9-23(10-12-24)13-18(25)22-17-8-4-3-7-16(17)21/h1-8H,9-13H2,(H,22,25)
• InChIKey: GASVWEKAZQEMBT-UHFFFAOYSA-N
• XLogP: 2.36
• TPSA: 52.65 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 4
• Heavy Atoms: 26
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	359.38
LogP ≤ 5	2.36
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide?

The IUPAC name of 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide (CID 15999180) is 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide.

What is the SMILES notation for 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide?

The canonical SMILES for 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide is O=C(CN1CCN(C(=O)c2ccccc2F)CC1)Nc1ccccc1F.

What is the InChIKey of 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide?

The InChIKey is GASVWEKAZQEMBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2N3O2/c20-15-6-2-1-5-14(15)19(26)24-11-9-23(10-12-24)13-18(25)22-17-8-4-3-7-16(17)21/h1-8H,9-13H2,(H,22,25).

What are the key properties of 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide?

2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide has a molecular weight of 359.38 g/mol, XLogP of 2.36, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[4-(2-fluorobenzoyl)piperazin-1-yl]-N-(2-fluorophenyl)acetamide is sourced from PubChem (CID 15999180), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Sources

• PubChem CID 15999180 — identifiers, structure, computed properties (public domain)

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