N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide

C19H19F2NO3 — CID 8551831

About N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide

N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide (PubChem CID 8551831) has the molecular formula C19H19F2NO3 and a molecular weight of 347.36 g/mol. Its IUPAC name is N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide.

Molecular Properties

• Compound Name: N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide
• PubChem CID: 8551831
• Molecular Formula: C19H19F2NO3
• Molecular Weight: 347.36 g/mol
• Exact Mass: 347.13
• IUPAC Name: N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide
• SMILES: CC1(C)Cc2cccc(OCC(=O)NCc3c(F)cccc3F)c2O1
• InChI: InChI=1S/C19H19F2NO3/c1-19(2)9-12-5-3-8-16(18(12)25-19)24-11-17(23)22-10-13-14(20)6-4-7-15(13)21/h3-8H,9-11H2,1-2H3,(H,22,23)
• InChIKey: CYXAYWVKCUSNJM-UHFFFAOYSA-N
• XLogP: 3.37
• TPSA: 47.56 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 3
• Rotatable Bonds: 5
• Heavy Atoms: 25
• Complexity: —

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	347.36
LogP ≤ 5	3.37
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide?

The IUPAC name of N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide (CID 8551831) is N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide.

What is the SMILES notation for N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide?

The canonical SMILES for N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide is CC1(C)Cc2cccc(OCC(=O)NCc3c(F)cccc3F)c2O1.

What is the InChIKey of N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide?

The InChIKey is CYXAYWVKCUSNJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19F2NO3/c1-19(2)9-12-5-3-8-16(18(12)25-19)24-11-17(23)22-10-13-14(20)6-4-7-15(13)21/h3-8H,9-11H2,1-2H3,(H,22,23).

What are the key properties of N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide?

N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide has a molecular weight of 347.36 g/mol, XLogP of 3.37, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for N-[(2,6-difluorophenyl)methyl]-2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]acetamide is sourced from PubChem (CID 8551831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).