2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide

C24H17F3N6O5 — CID 53496603

About 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide

2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide (PubChem CID 53496603) has the molecular formula C24H17F3N6O5 and a molecular weight of 526.43 g/mol. Its IUPAC name is 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide.

Molecular Properties

• Compound Name: 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide
• PubChem CID: 53496603
• Molecular Formula: C24H17F3N6O5
• Molecular Weight: 526.43 g/mol
• Exact Mass: 526.12
• IUPAC Name: 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide
• SMILES: Cc1nnc(CNC(=O)C(O)c2ccc(-c3noc(-c4onc(-c5ccccc5)c4C(F)(F)F)n3)cc2)o1
• InChI: InChI=1S/C24H17F3N6O5/c1-12-30-31-16(36-12)11-28-22(35)19(34)14-7-9-15(10-8-14)21-29-23(38-33-21)20-17(24(25,26)27)18(32-37-20)13-5-3-2-4-6-13/h2-10,19,34H,11H2,1H3,(H,28,35)
• InChIKey: DSVUBNIUZPSVHV-UHFFFAOYSA-N
• XLogP: 4.12
• TPSA: 153.20 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 10
• Rotatable Bonds: 7
• Heavy Atoms: 38
• Complexity: —

Lipinski Rule of Five

1 violation

Rule	Value
MW ≤ 500	526.43
LogP ≤ 5	4.12
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	10

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide?

The IUPAC name of 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide (CID 53496603) is 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide.

What is the SMILES notation for 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide?

The canonical SMILES for 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide is Cc1nnc(CNC(=O)C(O)c2ccc(-c3noc(-c4onc(-c5ccccc5)c4C(F)(F)F)n3)cc2)o1.

What is the InChIKey of 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide?

The InChIKey is DSVUBNIUZPSVHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17F3N6O5/c1-12-30-31-16(36-12)11-28-22(35)19(34)14-7-9-15(10-8-14)21-29-23(38-33-21)20-17(24(25,26)27)18(32-37-20)13-5-3-2-4-6-13/h2-10,19,34H,11H2,1H3,(H,28,35).

What are the key properties of 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide?

2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide has a molecular weight of 526.43 g/mol, XLogP of 4.12, 7 rotatable bonds, 2 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2-hydroxy-N-[(5-methyl-1,3,4-oxadiazol-2-yl)methyl]-2-[4-[5-[3-phenyl-4-(trifluoromethyl)-1,2-oxazol-5-yl]-1,2,4-oxadiazol-3-yl]phenyl]acetamide is sourced from PubChem (CID 53496603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).