N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide

C20H20N2O4S — CID 24665720

About N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide

N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide (PubChem CID 24665720) has the molecular formula C20H20N2O4S and a molecular weight of 384.46 g/mol. Its IUPAC name is N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide.

Molecular Properties

• Compound Name: N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide
• PubChem CID: 24665720
• Molecular Formula: C20H20N2O4S
• Molecular Weight: 384.46 g/mol
• Exact Mass: 384.11
• IUPAC Name: N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide
• SMILES: CCOc1cc2c(cc1NC(=O)Cc1csc(-c3ccco3)n1)OC(C)C2
• InChI: InChI=1S/C20H20N2O4S/c1-3-24-18-8-13-7-12(2)26-17(13)10-15(18)22-19(23)9-14-11-27-20(21-14)16-5-4-6-25-16/h4-6,8,10-12H,3,7,9H2,1-2H3,(H,22,23)
• InChIKey: KWMZPRVYKDQKCU-UHFFFAOYSA-N
• XLogP: 4.31
• TPSA: 73.59 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 6
• Rotatable Bonds: 6
• Heavy Atoms: 27
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	384.46
LogP ≤ 5	4.31
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	6

Frequently Asked Questions

What is the IUPAC name of N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide?

The IUPAC name of N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide (CID 24665720) is N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide.

What is the SMILES notation for N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide?

The canonical SMILES for N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide is CCOc1cc2c(cc1NC(=O)Cc1csc(-c3ccco3)n1)OC(C)C2.

What is the InChIKey of N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide?

The InChIKey is KWMZPRVYKDQKCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H20N2O4S/c1-3-24-18-8-13-7-12(2)26-17(13)10-15(18)22-19(23)9-14-11-27-20(21-14)16-5-4-6-25-16/h4-6,8,10-12H,3,7,9H2,1-2H3,(H,22,23).

What are the key properties of N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide?

N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide has a molecular weight of 384.46 g/mol, XLogP of 4.31, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.

Where does this data come from?

All data for N-(5-ethoxy-2-methyl-2,3-dihydro-1-benzofuran-6-yl)-2-[2-(furan-2-yl)-1,3-thiazol-4-yl]acetamide is sourced from PubChem (CID 24665720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).