2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate

C124H139Cl2F17N26O12Si4 — CID 157404718

About 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate

2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate (PubChem CID 157404718) has the molecular formula C124H139Cl2F17N26O12Si4 and a molecular weight of 2691.86 g/mol. Its IUPAC name is 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate.

Molecular Properties

• Compound Name: 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate
• PubChem CID: 157404718
• Molecular Formula: C124H139Cl2F17N26O12Si4
• Molecular Weight: 2691.86 g/mol
• Exact Mass: 2688.92
• IUPAC Name: 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate
• SMILES: C#CC(=O)OCC.CCOC(=O)c1cn(Cc2c(C(F)(F)F)c3cc(C4CC4)ccc3n2COCC[Si](C)(C)C)nn1.C[Si](C)(C)CCOCn1c(CN=[N+]=[N-])c(C(F)(F)F)c2cc(C3CC3)ccc21.C[Si](C)(C)CCOCn1c(Cn2cc(C(=O)NCc3ncn4ccc(Cl)c(F)c34)nn2)c(C(F)(F)F)c2cc(C3CC3)ccc21.C[Si](C)(C)CCOCn1c(Cn2cc(C(=O)O)nn2)c(C(F)(F)F)c2cc(C3CC3)ccc21.O=C(NCc1ncn2ccc(Cl)c(F)c12)c1cn(Cc2[nH]c3ccc(C4CC4)cc3c2C(F)(F)F)nn1
• InChI: InChI=1S/C30H32ClF4N7O2Si.C24H18ClF4N7O.C24H31F3N4O3Si.C22H27F3N4O3Si.C19H25F3N4OSi.C5H6O2/c1-45(2,3)11-10-44-17-42-24-7-6-19(18-4-5-18)12-20(24)26(30(33,34)35)25(42)15-41-14-23(38-39-41)29(43)36-13-22-28-27(32)21(31)8-9-40(28)16-37-22;25-15-5-6-35-11-31-17(22(35)21(15)26)8-30-23(37)19-10-36(34-33-19)9-18-20(24(27,28)29)14-7-13(12-1-2-12)3-4-16(14)32-18;1-5-34-23(32)19-13-30(29-28-19)14-21-22(24(25,26)27)18-12-17(16-6-7-16)8-9-20(18)31(21)15-33-10-11-35(2,3)4;1-33(2,3)9-8-32-13-29-18-7-6-15(14-4-5-14)10-16(18)20(22(23,24)25)19(29)12-28-11-17(21(30)31)26-27-28;1-28(2,3)9-8-27-12-26-16-7-6-14(13-4-5-13)10-15(16)18(19(20,21)22)17(26)11-24-25-23;1-3-5(6)7-4-2/h6-9,12,14,16,18H,4-5,10-11,13,15,17H2,1-3H3,(H,36,43);3-7,10-12,32H,1-2,8-9H2,(H,30,37);8-9,12-13,16H,5-7,10-11,14-15H2,1-4H3;6-7,10-11,14H,4-5,8-9,12-13H2,1-3H3,(H,30,31);6-7,10,13H,4-5,8-9,11-12H2,1-3H3;1H,4H2,2H3
• InChIKey: BNOXMSLHVJIWFY-UHFFFAOYSA-N
• XLogP: 29.63
• TPSA: 426.73 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 32
• Rotatable Bonds: 45
• Heavy Atoms: 185
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2691.86
LogP ≤ 5	29.63
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'Azido_group', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate?

The IUPAC name of 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate (CID 157404718) is 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate.

What is the SMILES notation for 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate?

The canonical SMILES for 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate is C#CC(=O)OCC.CCOC(=O)c1cn(Cc2c(C(F)(F)F)c3cc(C4CC4)ccc3n2COCC[Si](C)(C)C)nn1.C[Si](C)(C)CCOCn1c(CN=[N+]=[N-])c(C(F)(F)F)c2cc(C3CC3)ccc21.C[Si](C)(C)CCOCn1c(Cn2cc(C(=O)NCc3ncn4ccc(Cl)c(F)c34)nn2)c(C(F)(F)F)c2cc(C3CC3)ccc21.C[Si](C)(C)CCOCn1c(Cn2cc(C(=O)O)nn2)c(C(F)(F)F)c2cc(C3CC3)ccc21.O=C(NCc1ncn2ccc(Cl)c(F)c12)c1cn(Cc2[nH]c3ccc(C4CC4)cc3c2C(F)(F)F)nn1.

What is the InChIKey of 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate?

The InChIKey is BNOXMSLHVJIWFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H32ClF4N7O2Si.C24H18ClF4N7O.C24H31F3N4O3Si.C22H27F3N4O3Si.C19H25F3N4OSi.C5H6O2/c1-45(2,3)11-10-44-17-42-24-7-6-19(18-4-5-18)12-20(24)26(30(33,34)35)25(42)15-41-14-23(38-39-41)29(43)36-13-22-28-27(32)21(31)8-9-40(28)16-37-22;25-15-5-6-35-11-31-17(22(35)21(15)26)8-30-23(37)19-10-36(34-33-19)9-18-20(24(27,28)29)14-7-13(12-1-2-12)3-4-16(14)32-18;1-5-34-23(32)19-13-30(29-28-19)14-21-22(24(25,26)27)18-12-17(16-6-7-16)8-9-20(18)31(21)15-33-10-11-35(2,3)4;1-33(2,3)9-8-32-13-29-18-7-6-15(14-4-5-14)10-16(18)20(22(23,24)25)19(29)12-28-11-17(21(30)31)26-27-28;1-28(2,3)9-8-27-12-26-16-7-6-14(13-4-5-13)10-15(16)18(19(20,21)22)17(26)11-24-25-23;1-3-5(6)7-4-2/h6-9,12,14,16,18H,4-5,10-11,13,15,17H2,1-3H3,(H,36,43);3-7,10-12,32H,1-2,8-9H2,(H,30,37);8-9,12-13,16H,5-7,10-11,14-15H2,1-4H3;6-7,10-11,14H,4-5,8-9,12-13H2,1-3H3,(H,30,31);6-7,10,13H,4-5,8-9,11-12H2,1-3H3;1H,4H2,2H3.

What are the key properties of 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate?

2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate has a molecular weight of 2691.86 g/mol, XLogP of 29.63, 45 rotatable bonds, 4 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[[2-(azidomethyl)-5-cyclopropyl-3-(trifluoromethyl)indol-1-yl]methoxy]ethyl-trimethylsilane;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1H-indol-2-yl]methyl]triazole-4-carboxamide;N-[(7-chloro-8-fluoroimidazo[1,5-a]pyridin-1-yl)methyl]-1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxamide;1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylic acid;ethyl 1-[[5-cyclopropyl-3-(trifluoromethyl)-1-(2-trimethylsilylethoxymethyl)indol-2-yl]methyl]triazole-4-carboxylate;ethyl prop-2-ynoate is sourced from PubChem (CID 157404718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).