5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide

C145H134F7N13O24 — CID 157391786

About 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide

5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide (PubChem CID 157391786) has the molecular formula C145H134F7N13O24 and a molecular weight of 2575.72 g/mol. Its IUPAC name is 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide.

Molecular Properties

• Compound Name: 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide
• PubChem CID: 157391786
• Molecular Formula: C145H134F7N13O24
• Molecular Weight: 2575.72 g/mol
• Exact Mass: 2573.96
• IUPAC Name: 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide
• SMILES: CNC(=O)C(=O)c1c[nH]c2c(OC(C)C)cc3c(C(=O)NC)c(-c4ccc(C)cc4)oc3c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2c1cc(-c1ccc(OC)c(C(=O)CCC(F)(F)C(F)(F)C(F)(F)F)c1)c1[nH]ccc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2c1cc(-c1cccc(C(=O)NC(C)(C)C)c1)c1[nH]c(C)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2c1cc(-c1cccc(C(=O)NC(C)(C)C)c1)c1[nH]cc(C(=O)C(=O)OC)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2c1cc(OC(C)C)c1[nH]cc(C(=O)C(=O)O)c12
• InChI: InChI=1S/C33H31N3O6.C32H25F7N2O4.C31H31N3O3.C25H25N3O5.C24H22N2O6/c1-17-10-12-18(13-11-17)28-25(31(39)34-5)22-15-21(19-8-7-9-20(14-19)30(38)36-33(2,3)4)26-24(29(22)42-28)23(16-35-26)27(37)32(40)41-6;1-16-4-6-17(7-5-16)27-25(29(43)40-2)22-15-20(26-19(11-13-41-26)28(22)45-27)18-8-9-24(44-3)21(14-18)23(42)10-12-30(33,34)31(35,36)32(37,38)39;1-17-10-12-19(13-11-17)27-25(30(36)32-6)23-16-22(26-24(28(23)37-27)14-18(2)33-26)20-8-7-9-21(15-20)29(35)34-31(3,4)5;1-12(2)32-17-10-15-19(24(30)26-4)22(14-8-6-13(3)7-9-14)33-23(15)18-16(11-28-20(17)18)21(29)25(31)27-5;1-11(2)31-16-9-14-18(23(28)25-4)21(13-7-5-12(3)6-8-13)32-22(14)17-15(10-26-19(16)17)20(27)24(29)30/h7-16,35H,1-6H3,(H,34,39)(H,36,38);4-9,11,13-15,41H,10,12H2,1-3H3,(H,40,43);7-16,33H,1-6H3,(H,32,36)(H,34,35);6-12,28H,1-5H3,(H,26,30)(H,27,31);5-11,26H,1-4H3,(H,25,28)(H,29,30)
• InChIKey: BMBZUZZFWBQLFN-UHFFFAOYSA-N
• XLogP: 29.54
• TPSA: 537.02 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 23
• Rotatable Bonds: 31
• Heavy Atoms: 189
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2575.72
LogP ≤ 5	29.54
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'diketo_group', 'substructure': 'N/A'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide?

The IUPAC name of 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide (CID 157391786) is 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide.

What is the SMILES notation for 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide?

The canonical SMILES for 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide is CNC(=O)C(=O)c1c[nH]c2c(OC(C)C)cc3c(C(=O)NC)c(-c4ccc(C)cc4)oc3c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2c1cc(-c1ccc(OC)c(C(=O)CCC(F)(F)C(F)(F)C(F)(F)F)c1)c1[nH]ccc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2c1cc(-c1cccc(C(=O)NC(C)(C)C)c1)c1[nH]c(C)cc12.CNC(=O)c1c(-c2ccc(C)cc2)oc2c1cc(-c1cccc(C(=O)NC(C)(C)C)c1)c1[nH]cc(C(=O)C(=O)OC)c12.CNC(=O)c1c(-c2ccc(C)cc2)oc2c1cc(OC(C)C)c1[nH]cc(C(=O)C(=O)O)c12.

What is the InChIKey of 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide?

The InChIKey is BMBZUZZFWBQLFN-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H31N3O6.C32H25F7N2O4.C31H31N3O3.C25H25N3O5.C24H22N2O6/c1-17-10-12-18(13-11-17)28-25(31(39)34-5)22-15-21(19-8-7-9-20(14-19)30(38)36-33(2,3)4)26-24(29(22)42-28)23(16-35-26)27(37)32(40)41-6;1-16-4-6-17(7-5-16)27-25(29(43)40-2)22-15-20(26-19(11-13-41-26)28(22)45-27)18-8-9-24(44-3)21(14-18)23(42)10-12-30(33,34)31(35,36)32(37,38)39;1-17-10-12-19(13-11-17)27-25(30(36)32-6)23-16-22(26-24(28(23)37-27)14-18(2)33-26)20-8-7-9-21(15-20)29(35)34-31(3,4)5;1-12(2)32-17-10-15-19(24(30)26-4)22(14-8-6-13(3)7-9-14)33-23(15)18-16(11-28-20(17)18)21(29)25(31)27-5;1-11(2)31-16-9-14-18(23(28)25-4)21(13-7-5-12(3)6-8-13)32-22(14)17-15(10-26-19(16)17)20(27)24(29)30/h7-16,35H,1-6H3,(H,34,39)(H,36,38);4-9,11,13-15,41H,10,12H2,1-3H3,(H,40,43);7-16,33H,1-6H3,(H,32,36)(H,34,35);6-12,28H,1-5H3,(H,26,30)(H,27,31);5-11,26H,1-4H3,(H,25,28)(H,29,30).

What are the key properties of 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide?

5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide has a molecular weight of 2575.72 g/mol, XLogP of 29.54, 31 rotatable bonds, 14 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[3-(tert-butylcarbamoyl)phenyl]-N,7-dimethyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;5-[3-(4,4,5,5,6,6,6-heptafluorohexanoyl)-4-methoxyphenyl]-N-methyl-2-(4-methylphenyl)-6H-furo[2,3-e]indole-3-carboxamide;methyl 2-[5-[3-(tert-butylcarbamoyl)phenyl]-3-(methylcarbamoyl)-2-(4-methylphenyl)-6H-furo[2,3-e]indol-8-yl]-2-oxoacetate;2-[3-(methylcarbamoyl)-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indol-8-yl]-2-oxoacetic acid;N-methyl-8-[2-(methylamino)-2-oxoacetyl]-2-(4-methylphenyl)-5-propan-2-yloxy-6H-furo[2,3-e]indole-3-carboxamide is sourced from PubChem (CID 157391786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).