4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide

C19H24FN5O3 — CID 175661343

About 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide

4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide (PubChem CID 175661343) has the molecular formula C19H24FN5O3 and a molecular weight of 389.43 g/mol. Its IUPAC name is 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide.

Molecular Properties

• Compound Name: 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide
• PubChem CID: 175661343
• Molecular Formula: C19H24FN5O3
• Molecular Weight: 389.43 g/mol
• Exact Mass: 389.19
• IUPAC Name: 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide
• SMILES: CC(C)c1nnc(CCC(=O)N2CCN(c3ccc(F)cc3)CC2C(N)=O)o1
• InChI: InChI=1S/C19H24FN5O3/c1-12(2)19-23-22-16(28-19)7-8-17(26)25-10-9-24(11-15(25)18(21)27)14-5-3-13(20)4-6-14/h3-6,12,15H,7-11H2,1-2H3,(H2,21,27)
• InChIKey: VYDUXXGMBRTQBA-UHFFFAOYSA-N
• XLogP: 1.47
• TPSA: 105.56 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 28
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	389.43
LogP ≤ 5	1.47
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide?

The IUPAC name of 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide (CID 175661343) is 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide.

What is the SMILES notation for 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide?

The canonical SMILES for 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide is CC(C)c1nnc(CCC(=O)N2CCN(c3ccc(F)cc3)CC2C(N)=O)o1.

What is the InChIKey of 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide?

The InChIKey is VYDUXXGMBRTQBA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24FN5O3/c1-12(2)19-23-22-16(28-19)7-8-17(26)25-10-9-24(11-15(25)18(21)27)14-5-3-13(20)4-6-14/h3-6,12,15H,7-11H2,1-2H3,(H2,21,27).

What are the key properties of 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide?

4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide has a molecular weight of 389.43 g/mol, XLogP of 1.47, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 4-(4-fluorophenyl)-1-[3-(5-propan-2-yl-1,3,4-oxadiazol-2-yl)propanoyl]piperazine-2-carboxamide is sourced from PubChem (CID 175661343), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).