N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide

C24H21N3O5 — CID 55448011

About N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide

N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide (PubChem CID 55448011) has the molecular formula C24H21N3O5 and a molecular weight of 431.45 g/mol. Its IUPAC name is N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide.

Molecular Properties

• Compound Name: N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
• PubChem CID: 55448011
• Molecular Formula: C24H21N3O5
• Molecular Weight: 431.45 g/mol
• Exact Mass: 431.15
• IUPAC Name: N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
• SMILES: O=C(Cc1coc(-c2ccccc2)n1)Nc1c(C(=O)N2CCOCC2)oc2ccccc12
• InChI: InChI=1S/C24H21N3O5/c28-20(14-17-15-31-23(25-17)16-6-2-1-3-7-16)26-21-18-8-4-5-9-19(18)32-22(21)24(29)27-10-12-30-13-11-27/h1-9,15H,10-14H2,(H,26,28)
• InChIKey: VXZYYWQJJORTTB-UHFFFAOYSA-N
• XLogP: 3.74
• TPSA: 97.81 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 5
• Heavy Atoms: 32
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	431.45
LogP ≤ 5	3.74
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?

The IUPAC name of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide (CID 55448011) is N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide.

What is the SMILES notation for N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?

The canonical SMILES for N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide is O=C(Cc1coc(-c2ccccc2)n1)Nc1c(C(=O)N2CCOCC2)oc2ccccc12.

What is the InChIKey of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?

The InChIKey is VXZYYWQJJORTTB-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3O5/c28-20(14-17-15-31-23(25-17)16-6-2-1-3-7-16)26-21-18-8-4-5-9-19(18)32-22(21)24(29)27-10-12-30-13-11-27/h1-9,15H,10-14H2,(H,26,28).

What are the key properties of N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide?

N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide has a molecular weight of 431.45 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-[2-(morpholine-4-carbonyl)-1-benzofuran-3-yl]-2-(2-phenyl-1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 55448011), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).