2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide

C112H118N14O16S5 — CID 167584049

About 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide

2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide (PubChem CID 167584049) has the molecular formula C112H118N14O16S5 and a molecular weight of 2076.59 g/mol. Its IUPAC name is 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide.

Molecular Properties

• Compound Name: 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide
• PubChem CID: 167584049
• Molecular Formula: C112H118N14O16S5
• Molecular Weight: 2076.59 g/mol
• Exact Mass: 2074.75
• IUPAC Name: 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide
• SMILES: COc1ccccc1N(C(=O)COc1cccc2c1OC(C)(C)C2)c1nc(C)cs1.Cc1csc(N(CCc2ccccc2)C(=O)COc2cccc3c2OC(C)(C)C3)n1.Cc1csc(N(Cc2cccnc2)C(=O)COc2cccc3c2OC(C)(C)C3)n1.Cc1csc(N(Cc2ccncc2)C(=O)COc2cccc3c2OC(C)(C)C3)n1.Cc1csc(N(Cc2ncccn2)C(=O)COc2cccc3c2OC(C)(C)C3)n1
• InChI: InChI=1S/C24H26N2O3S.C23H24N2O4S.2C22H23N3O3S.C21H22N4O3S/c1-17-16-30-23(25-17)26(13-12-18-8-5-4-6-9-18)21(27)15-28-20-11-7-10-19-14-24(2,3)29-22(19)20;1-15-14-30-22(24-15)25(17-9-5-6-10-18(17)27-4)20(26)13-28-19-11-7-8-16-12-23(2,3)29-21(16)19;1-15-14-29-21(24-15)25(12-16-6-5-9-23-11-16)19(26)13-27-18-8-4-7-17-10-22(2,3)28-20(17)18;1-15-14-29-21(24-15)25(12-16-7-9-23-10-8-16)19(26)13-27-18-6-4-5-17-11-22(2,3)28-20(17)18;1-14-13-29-20(24-14)25(11-17-22-8-5-9-23-17)18(26)12-27-16-7-4-6-15-10-21(2,3)28-19(15)16/h4-11,16H,12-15H2,1-3H3;5-11,14H,12-13H2,1-4H3;4-9,11,14H,10,12-13H2,1-3H3;4-10,14H,11-13H2,1-3H3;4-9,13H,10-12H2,1-3H3
• InChIKey: HNZVCTTVLNJNLE-UHFFFAOYSA-N
• XLogP: 21.65
• TPSA: 319.09 Ų
• H-Bond Acceptors: 30
• Rotatable Bonds: 31
• Heavy Atoms: 147
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2076.59
LogP ≤ 5	21.65
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	30

Frequently Asked Questions

What is the IUPAC name of 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide?

The IUPAC name of 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide (CID 167584049) is 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide.

What is the SMILES notation for 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide?

The canonical SMILES for 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide is COc1ccccc1N(C(=O)COc1cccc2c1OC(C)(C)C2)c1nc(C)cs1.Cc1csc(N(CCc2ccccc2)C(=O)COc2cccc3c2OC(C)(C)C3)n1.Cc1csc(N(Cc2cccnc2)C(=O)COc2cccc3c2OC(C)(C)C3)n1.Cc1csc(N(Cc2ccncc2)C(=O)COc2cccc3c2OC(C)(C)C3)n1.Cc1csc(N(Cc2ncccn2)C(=O)COc2cccc3c2OC(C)(C)C3)n1.

What is the InChIKey of 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide?

The InChIKey is HNZVCTTVLNJNLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H26N2O3S.C23H24N2O4S.2C22H23N3O3S.C21H22N4O3S/c1-17-16-30-23(25-17)26(13-12-18-8-5-4-6-9-18)21(27)15-28-20-11-7-10-19-14-24(2,3)29-22(19)20;1-15-14-30-22(24-15)25(17-9-5-6-10-18(17)27-4)20(26)13-28-19-11-7-8-16-12-23(2,3)29-21(16)19;1-15-14-29-21(24-15)25(12-16-6-5-9-23-11-16)19(26)13-27-18-8-4-7-17-10-22(2,3)28-20(17)18;1-15-14-29-21(24-15)25(12-16-7-9-23-10-8-16)19(26)13-27-18-6-4-5-17-11-22(2,3)28-20(17)18;1-14-13-29-20(24-14)25(11-17-22-8-5-9-23-17)18(26)12-27-16-7-4-6-15-10-21(2,3)28-19(15)16/h4-11,16H,12-15H2,1-3H3;5-11,14H,12-13H2,1-4H3;4-9,11,14H,10,12-13H2,1-3H3;4-10,14H,11-13H2,1-3H3;4-9,13H,10-12H2,1-3H3.

What are the key properties of 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide?

2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide has a molecular weight of 2076.59 g/mol, XLogP of 21.65, 31 rotatable bonds, 0 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(2-methoxyphenyl)-N-(4-methyl-1,3-thiazol-2-yl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(2-phenylethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-3-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyridin-4-ylmethyl)acetamide;2-[(2,2-dimethyl-3H-1-benzofuran-7-yl)oxy]-N-(4-methyl-1,3-thiazol-2-yl)-N-(pyrimidin-2-ylmethyl)acetamide is sourced from PubChem (CID 167584049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).