2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide

C24H16FN3O4 — CID 154833789

About 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide

2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide (PubChem CID 154833789) has the molecular formula C24H16FN3O4 and a molecular weight of 429.41 g/mol. Its IUPAC name is 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide.

Molecular Properties

• Compound Name: 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide
• PubChem CID: 154833789
• Molecular Formula: C24H16FN3O4
• Molecular Weight: 429.41 g/mol
• Exact Mass: 429.11
• IUPAC Name: 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide
• SMILES: Cn1c(=O)oc2ccc(NC(=O)c3ccccc3-c3ncc(-c4ccccc4F)o3)cc21
• InChI: InChI=1S/C24H16FN3O4/c1-28-19-12-14(10-11-20(19)32-24(28)30)27-22(29)15-6-2-3-7-16(15)23-26-13-21(31-23)17-8-4-5-9-18(17)25/h2-13H,1H3,(H,27,29)
• InChIKey: NVTXWUHRCULGPB-UHFFFAOYSA-N
• XLogP: 4.84
• TPSA: 90.27 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 4
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	429.41
LogP ≤ 5	4.84
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide?

The IUPAC name of 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide (CID 154833789) is 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide.

What is the SMILES notation for 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide?

The canonical SMILES for 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide is Cn1c(=O)oc2ccc(NC(=O)c3ccccc3-c3ncc(-c4ccccc4F)o3)cc21.

What is the InChIKey of 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide?

The InChIKey is NVTXWUHRCULGPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H16FN3O4/c1-28-19-12-14(10-11-20(19)32-24(28)30)27-22(29)15-6-2-3-7-16(15)23-26-13-21(31-23)17-8-4-5-9-18(17)25/h2-13H,1H3,(H,27,29).

What are the key properties of 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide?

2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide has a molecular weight of 429.41 g/mol, XLogP of 4.84, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[5-(2-fluorophenyl)-1,3-oxazol-2-yl]-N-(3-methyl-2-oxo-1,3-benzoxazol-5-yl)benzamide is sourced from PubChem (CID 154833789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).