5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane

C61H85BBr2N10O7Si3 — CID 161413144

About 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane

5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane (PubChem CID 161413144) has the molecular formula C61H85BBr2N10O7Si3 and a molecular weight of 1325.29 g/mol. Its IUPAC name is 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane.

Molecular Properties

• Compound Name: 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane
• PubChem CID: 161413144
• Molecular Formula: C61H85BBr2N10O7Si3
• Molecular Weight: 1325.29 g/mol
• Exact Mass: 1322.44
• IUPAC Name: 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane
• SMILES: Brc1cnc2[nH]ccc2c1.CC1(C)OB(c2cnc3c(ccn3COCC[Si](C)(C)C)c2)OC1(C)C.CN(C)C(=O)C(O)c1cncc(-c2cnc3c(ccn3COCC[Si](C)(C)C)c2)c1.C[Si](C)(C)CCOCn1ccc2cc(Br)cnc21
• InChI: InChI=1S/C22H30N4O3Si.C19H31BN2O3Si.C13H19BrN2OSi.C7H5BrN2/c1-25(2)22(28)20(27)19-11-17(12-23-13-19)18-10-16-6-7-26(21(16)24-14-18)15-29-8-9-30(3,4)5;1-18(2)19(3,4)25-20(24-18)16-12-15-8-9-22(17(15)21-13-16)14-23-10-11-26(5,6)7;1-18(2,3)7-6-17-10-16-5-4-11-8-12(14)9-15-13(11)16;8-6-3-5-1-2-9-7(5)10-4-6/h6-7,10-14,20,27H,8-9,15H2,1-5H3;8-9,12-13H,10-11,14H2,1-7H3;4-5,8-9H,6-7,10H2,1-3H3;1-4H,(H,9,10)
• InChIKey: VVSWUUNFERHHDM-UHFFFAOYSA-N
• XLogP: 13.62
• TPSA: 181.72 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 15
• Rotatable Bonds: 19
• Heavy Atoms: 84
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1325.29
LogP ≤ 5	13.62
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'Aliphatic_long_chain', '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;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane?

The IUPAC name of 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane (CID 161413144) is 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane.

What is the SMILES notation for 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane?

The canonical SMILES for 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane is Brc1cnc2[nH]ccc2c1.CC1(C)OB(c2cnc3c(ccn3COCC[Si](C)(C)C)c2)OC1(C)C.CN(C)C(=O)C(O)c1cncc(-c2cnc3c(ccn3COCC[Si](C)(C)C)c2)c1.C[Si](C)(C)CCOCn1ccc2cc(Br)cnc21.

What is the InChIKey of 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane?

The InChIKey is VVSWUUNFERHHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H30N4O3Si.C19H31BN2O3Si.C13H19BrN2OSi.C7H5BrN2/c1-25(2)22(28)20(27)19-11-17(12-23-13-19)18-10-16-6-7-26(21(16)24-14-18)15-29-8-9-30(3,4)5;1-18(2)19(3,4)25-20(24-18)16-12-15-8-9-22(17(15)21-13-16)14-23-10-11-26(5,6)7;1-18(2,3)7-6-17-10-16-5-4-11-8-12(14)9-15-13(11)16;8-6-3-5-1-2-9-7(5)10-4-6/h6-7,10-14,20,27H,8-9,15H2,1-5H3;8-9,12-13H,10-11,14H2,1-7H3;4-5,8-9H,6-7,10H2,1-3H3;1-4H,(H,9,10).

What are the key properties of 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane?

5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane has a molecular weight of 1325.29 g/mol, XLogP of 13.62, 19 rotatable bonds, 2 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-1H-pyrrolo[2,3-b]pyridine;2-[(5-bromopyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;2-hydroxy-N,N-dimethyl-2-[5-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-5-yl]-3-pyridinyl]acetamide;trimethyl-[2-[[5-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[2,3-b]pyridin-1-yl]methoxy]ethyl]silane is sourced from PubChem (CID 161413144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).