3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione

C146H120N12O33 — CID 160878850

About 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione

3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione (PubChem CID 160878850) has the molecular formula C146H120N12O33 and a molecular weight of 2570.62 g/mol. Its IUPAC name is 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione.

Molecular Properties

• Compound Name: 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione
• PubChem CID: 160878850
• Molecular Formula: C146H120N12O33
• Molecular Weight: 2570.62 g/mol
• Exact Mass: 2568.81
• IUPAC Name: 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione
• SMILES: CN(C)CCOc1ccc2c(ccc3occ(C4CCC(=O)CC4=O)c32)c1.Cc1cc2c(ccc3occ(C4CCC(=O)NC4=O)c32)o1.Cn1ncc2c3c(C4CCC(=O)NC4=O)coc3ccc21.O=C1CCC(c2coc3ccc4[nH]ccc4c23)C(=O)C1.O=C1CCC(c2coc3ccc4c(c23)OCO4)C(=O)N1.O=C1CCC(c2coc3ccc4ccccc4c23)C(=O)N1.O=C1CCC(c2coc3ccc4ccoc4c23)C(=O)N1.O=C1CCC(c2coc3ccc4ncccc4c23)C(=O)N1.O=C1CCC(c2coc3ccc4occc4c23)C(=O)N1
• InChI: InChI=1S/C22H23NO4.C17H13NO3.C16H12N2O3.C16H13NO4.C16H13NO3.C15H13N3O3.2C15H11NO4.C14H11NO5/c1-23(2)9-10-26-16-5-7-17-14(11-16)3-8-21-22(17)19(13-27-21)18-6-4-15(24)12-20(18)25;19-15-8-6-12(17(20)18-15)13-9-21-14-7-5-10-3-1-2-4-11(10)16(13)14;19-14-6-3-9(16(20)18-14)11-8-21-13-5-4-12-10(15(11)13)2-1-7-17-12;1-8-6-10-12(21-8)3-4-13-15(10)11(7-20-13)9-2-5-14(18)17-16(9)19;18-9-1-2-10(14(19)7-9)12-8-20-15-4-3-13-11(16(12)15)5-6-17-13;1-18-11-3-4-12-14(9(11)6-16-18)10(7-21-12)8-2-5-13(19)17-15(8)20;17-13-4-1-8(15(18)16-13)10-7-20-12-3-2-11-9(14(10)12)5-6-19-11;17-12-4-2-9(15(18)16-12)10-7-20-11-3-1-8-5-6-19-14(8)13(10)11;16-11-4-1-7(14(17)15-11)8-5-18-9-2-3-10-13(12(8)9)20-6-19-10/h3,5,7-8,11,13,18H,4,6,9-10,12H2,1-2H3;1-5,7,9,12H,6,8H2,(H,18,19,20);1-2,4-5,7-9H,3,6H2,(H,18,19,20);3-4,6-7,9H,2,5H2,1H3,(H,17,18,19);3-6,8,10,17H,1-2,7H2;3-4,6-8H,2,5H2,1H3,(H,17,19,20);2-3,5-8H,1,4H2,(H,16,17,18);1,3,5-7,9H,2,4H2,(H,16,17,18);2-3,5,7H,1,4,6H2,(H,15,16,17)
• InChIKey: SMTNQFYRTCPHKM-UHFFFAOYSA-N
• XLogP: 24.79
• TPSA: 626.58 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 37
• Rotatable Bonds: 13
• Heavy Atoms: 191
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2570.62
LogP ≤ 5	24.79
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}, {'alert_name': 'phthalimide', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione?

The IUPAC name of 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione (CID 160878850) is 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione.

What is the SMILES notation for 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione?

The canonical SMILES for 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione is CN(C)CCOc1ccc2c(ccc3occ(C4CCC(=O)CC4=O)c32)c1.Cc1cc2c(ccc3occ(C4CCC(=O)NC4=O)c32)o1.Cn1ncc2c3c(C4CCC(=O)NC4=O)coc3ccc21.O=C1CCC(c2coc3ccc4[nH]ccc4c23)C(=O)C1.O=C1CCC(c2coc3ccc4c(c23)OCO4)C(=O)N1.O=C1CCC(c2coc3ccc4ccccc4c23)C(=O)N1.O=C1CCC(c2coc3ccc4ccoc4c23)C(=O)N1.O=C1CCC(c2coc3ccc4ncccc4c23)C(=O)N1.O=C1CCC(c2coc3ccc4occc4c23)C(=O)N1.

What is the InChIKey of 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione?

The InChIKey is SMTNQFYRTCPHKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO4.C17H13NO3.C16H12N2O3.C16H13NO4.C16H13NO3.C15H13N3O3.2C15H11NO4.C14H11NO5/c1-23(2)9-10-26-16-5-7-17-14(11-16)3-8-21-22(17)19(13-27-21)18-6-4-15(24)12-20(18)25;19-15-8-6-12(17(20)18-15)13-9-21-14-7-5-10-3-1-2-4-11(10)16(13)14;19-14-6-3-9(16(20)18-14)11-8-21-13-5-4-12-10(15(11)13)2-1-7-17-12;1-8-6-10-12(21-8)3-4-13-15(10)11(7-20-13)9-2-5-14(18)17-16(9)19;18-9-1-2-10(14(19)7-9)12-8-20-15-4-3-13-11(16(12)15)5-6-17-13;1-18-11-3-4-12-14(9(11)6-16-18)10(7-21-12)8-2-5-13(19)17-15(8)20;17-13-4-1-8(15(18)16-13)10-7-20-12-3-2-11-9(14(10)12)5-6-19-11;17-12-4-2-9(15(18)16-12)10-7-20-11-3-1-8-5-6-19-14(8)13(10)11;16-11-4-1-7(14(17)15-11)8-5-18-9-2-3-10-13(12(8)9)20-6-19-10/h3,5,7-8,11,13,18H,4,6,9-10,12H2,1-2H3;1-5,7,9,12H,6,8H2,(H,18,19,20);1-2,4-5,7-9H,3,6H2,(H,18,19,20);3-4,6-7,9H,2,5H2,1H3,(H,17,18,19);3-6,8,10,17H,1-2,7H2;3-4,6-8H,2,5H2,1H3,(H,17,19,20);2-3,5-8H,1,4H2,(H,16,17,18);1,3,5-7,9H,2,4H2,(H,16,17,18);2-3,5,7H,1,4,6H2,(H,15,16,17).

What are the key properties of 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione?

3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione has a molecular weight of 2570.62 g/mol, XLogP of 24.79, 13 rotatable bonds, 8 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 3-benzo[e][1]benzofuran-1-ylpiperidine-2,6-dione;4-[7-[2-(dimethylamino)ethoxy]benzo[e][1]benzofuran-1-yl]cyclohexane-1,3-dione;3-furo[2,3-e][1]benzofuran-8-ylpiperidine-2,6-dione;3-furo[3,2-e][1]benzofuran-1-ylpiperidine-2,6-dione;4-(6H-furo[3,2-e]indol-1-yl)cyclohexane-1,3-dione;3-furo[3,2-f]quinolin-1-ylpiperidine-2,6-dione;3-furo[2,3-g][1,3]benzodioxol-8-ylpiperidine-2,6-dione;3-(2-methylfuro[3,2-e][1]benzofuran-8-yl)piperidine-2,6-dione;3-(3-methylfuro[3,2-e]indazol-8-yl)piperidine-2,6-dione is sourced from PubChem (CID 160878850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).