5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol

C145H173BrF3N20O12Si3+ — CID 158197609

About 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol

5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol (PubChem CID 158197609) has the molecular formula C145H173BrF3N20O12Si3+ and a molecular weight of 2609.26 g/mol. Its IUPAC name is 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol.

Molecular Properties

• Compound Name: 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol
• PubChem CID: 158197609
• Molecular Formula: C145H173BrF3N20O12Si3+
• Molecular Weight: 2609.26 g/mol
• Exact Mass: 2606.20
• IUPAC Name: 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol
• SMILES: Brc1cnc2[nH]ccc2c1.CC(C)(C)OC(=O)N(Cc1ccc(C(F)(F)F)cc1)c1ccc(C=O)cn1.CC(C)[Si](Oc1cnc2c(c1)C=[C+]N2)(C(C)C)C(C)C.COc1cnc2[nH]ccc2c1.Cc1ccc(CCc2ccc(Cc3c[nH]c4ncc(O)cc34)cn2)cc1.Cc1ccc(CCc2ccc(Cc3c[nH]c4ncc(O[Si](C(C)C)(C(C)C)C(C)C)cc34)cn2)cc1.Cc1ccc(CN(C(=O)OC(C)(C)C)c2ccc(C(O)c3c[nH]c4ncc(O[Si](C(C)C)(C(C)C)C(C)C)cc34)cn2)cc1.Oc1cnc2[nH]ccc2c1
• InChI: InChI=1S/C35H48N4O4Si.C31H41N3OSi.C22H21N3O.C19H19F3N2O3.C16H25N2OSi.C8H8N2O.C7H5BrN2.C7H6N2O/c1-22(2)44(23(3)4,24(5)6)43-28-17-29-30(20-38-33(29)37-19-28)32(40)27-15-16-31(36-18-27)39(34(41)42-35(8,9)10)21-26-13-11-25(7)12-14-26;1-21(2)36(22(3)4,23(5)6)35-29-17-30-27(19-33-31(30)34-20-29)16-26-13-15-28(32-18-26)14-12-25-10-8-24(7)9-11-25;1-15-2-4-16(5-3-15)6-8-19-9-7-17(12-23-19)10-18-13-24-22-21(18)11-20(26)14-25-22;1-18(2,3)27-17(26)24(16-9-6-14(12-25)10-23-16)11-13-4-7-15(8-5-13)19(20,21)22;1-11(2)20(12(3)4,13(5)6)19-15-9-14-7-8-17-16(14)18-10-15;1-11-7-4-6-2-3-9-8(6)10-5-7;8-6-3-5-1-2-9-7(5)10-4-6;10-6-3-5-1-2-8-7(5)9-4-6/h11-20,22-24,32,40H,21H2,1-10H3,(H,37,38);8-11,13,15,17-23H,12,14,16H2,1-7H3,(H,33,34);2-5,7,9,11-14,26H,6,8,10H2,1H3,(H,24,25);4-10,12H,11H2,1-3H3;7,9-13H,1-6H3,(H,17,18);2-5H,1H3,(H,9,10);1-4H,(H,9,10);1-4,10H,(H,8,9)/q;;;;+1
• InChIKey: GANJHICDJOBYLR-UHFFFAOYSA-N
• XLogP: 36.24
• TPSA: 422.32 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 24
• Rotatable Bonds: 35
• Heavy Atoms: 184
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2609.26
LogP ≤ 5	36.24
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}, {'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol?

The IUPAC name of 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol (CID 158197609) is 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol.

What is the SMILES notation for 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol?

The canonical SMILES for 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol is Brc1cnc2[nH]ccc2c1.CC(C)(C)OC(=O)N(Cc1ccc(C(F)(F)F)cc1)c1ccc(C=O)cn1.CC(C)[Si](Oc1cnc2c(c1)C=[C+]N2)(C(C)C)C(C)C.COc1cnc2[nH]ccc2c1.Cc1ccc(CCc2ccc(Cc3c[nH]c4ncc(O)cc34)cn2)cc1.Cc1ccc(CCc2ccc(Cc3c[nH]c4ncc(O[Si](C(C)C)(C(C)C)C(C)C)cc34)cn2)cc1.Cc1ccc(CN(C(=O)OC(C)(C)C)c2ccc(C(O)c3c[nH]c4ncc(O[Si](C(C)C)(C(C)C)C(C)C)cc34)cn2)cc1.Oc1cnc2[nH]ccc2c1.

What is the InChIKey of 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol?

The InChIKey is GANJHICDJOBYLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C35H48N4O4Si.C31H41N3OSi.C22H21N3O.C19H19F3N2O3.C16H25N2OSi.C8H8N2O.C7H5BrN2.C7H6N2O/c1-22(2)44(23(3)4,24(5)6)43-28-17-29-30(20-38-33(29)37-19-28)32(40)27-15-16-31(36-18-27)39(34(41)42-35(8,9)10)21-26-13-11-25(7)12-14-26;1-21(2)36(22(3)4,23(5)6)35-29-17-30-27(19-33-31(30)34-20-29)16-26-13-15-28(32-18-26)14-12-25-10-8-24(7)9-11-25;1-15-2-4-16(5-3-15)6-8-19-9-7-17(12-23-19)10-18-13-24-22-21(18)11-20(26)14-25-22;1-18(2,3)27-17(26)24(16-9-6-14(12-25)10-23-16)11-13-4-7-15(8-5-13)19(20,21)22;1-11(2)20(12(3)4,13(5)6)19-15-9-14-7-8-17-16(14)18-10-15;1-11-7-4-6-2-3-9-8(6)10-5-7;8-6-3-5-1-2-9-7(5)10-4-6;10-6-3-5-1-2-8-7(5)9-4-6/h11-20,22-24,32,40H,21H2,1-10H3,(H,37,38);8-11,13,15,17-23H,12,14,16H2,1-7H3,(H,33,34);2-5,7,9,11-14,26H,6,8,10H2,1H3,(H,24,25);4-10,12H,11H2,1-3H3;7,9-13H,1-6H3,(H,17,18);2-5H,1H3,(H,9,10);1-4H,(H,9,10);1-4,10H,(H,8,9)/q;;;;+1;;;.

What are the key properties of 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol?

5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol has a molecular weight of 2609.26 g/mol, XLogP of 36.24, 35 rotatable bonds, 10 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-1H-pyrrolo[2,3-b]pyridine;tert-butyl N-(5-formyl-2-pyridinyl)-N-[[4-(trifluoromethyl)phenyl]methyl]carbamate;tert-butyl N-[5-[hydroxy-[5-tri(propan-2-yl)silyloxy-1H-pyrrolo[2,3-b]pyridin-3-yl]methyl]-2-pyridinyl]-N-[(4-methylphenyl)methyl]carbamate;1,2-dihydropyrrolo[2,3-b]pyridin-2-ylium-5-yloxy-tri(propan-2-yl)silane;5-methoxy-1H-pyrrolo[2,3-b]pyridine;3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-ol;[3-[[6-[2-(4-methylphenyl)ethyl]-3-pyridinyl]methyl]-1H-pyrrolo[2,3-b]pyridin-5-yl]oxy-tri(propan-2-yl)silane;1H-pyrrolo[2,3-b]pyridin-5-ol is sourced from PubChem (CID 158197609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).