4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate

C136H185BrCl2FN19O10 — CID 158247196

About 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate

4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate (PubChem CID 158247196) has the molecular formula C136H185BrCl2FN19O10 and a molecular weight of 2415.91 g/mol. Its IUPAC name is 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate.

Molecular Properties

• Compound Name: 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate
• PubChem CID: 158247196
• Molecular Formula: C136H185BrCl2FN19O10
• Molecular Weight: 2415.91 g/mol
• Exact Mass: 2412.31
• IUPAC Name: 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate
• SMILES: CCc1cn(CCCCOC)c2nc(C)ccc12.CCc1cn(CCCCOC)c2nccc(Cl)c12.CCc1cn(CCCCOC)c2nccc(F)c12.CCc1cn(CCCCOC)c2ncccc12.CCc1cn(CCCNC(=O)OC)c2ncccc12.CCc1cn(CCCOC)c2nc(C)cc(Cl)c12.CCc1cn(CCCOC)c2nccc(-c3ccccc3)c12.CCc1cn(CCCOC)c2nccc(Br)c12.CCc1cn(CCCOC)c2nccc(C3CCCCC3)c12
• InChI: InChI=1S/C19H28N2O.C19H22N2O.C15H22N2O.2C14H19ClN2O.C14H19FN2O.C14H19N3O2.C14H20N2O.C13H17BrN2O/c2*1-3-15-14-21(12-7-13-22-2)19-18(15)17(10-11-20-19)16-8-5-4-6-9-16;1-4-13-11-17(9-5-6-10-18-3)15-14(13)8-7-12(2)16-15;1-4-11-9-17(6-5-7-18-3)14-13(11)12(15)8-10(2)16-14;2*1-3-11-10-17(8-4-5-9-18-2)14-13(11)12(15)6-7-16-14;1-3-11-10-17(9-5-8-16-14(18)19-2)13-12(11)6-4-7-15-13;1-3-12-11-16(9-4-5-10-17-2)14-13(12)7-6-8-15-14;1-3-10-9-16(7-4-8-17-2)13-12(10)11(14)5-6-15-13/h10-11,14,16H,3-9,12-13H2,1-2H3;4-6,8-11,14H,3,7,12-13H2,1-2H3;7-8,11H,4-6,9-10H2,1-3H3;8-9H,4-7H2,1-3H3;2*6-7,10H,3-5,8-9H2,1-2H3;4,6-7,10H,3,5,8-9H2,1-2H3,(H,16,18);6-8,11H,3-5,9-10H2,1-2H3;5-6,9H,3-4,7-8H2,1-2H3
• InChIKey: GGGMTTWFGAYCMI-UHFFFAOYSA-N
• XLogP: 31.53
• TPSA: 272.55 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 28
• Rotatable Bonds: 51
• Heavy Atoms: 169
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2415.91
LogP ≤ 5	31.53
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate?

The IUPAC name of 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate (CID 158247196) is 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate.

What is the SMILES notation for 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate?

The canonical SMILES for 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate is CCc1cn(CCCCOC)c2nc(C)ccc12.CCc1cn(CCCCOC)c2nccc(Cl)c12.CCc1cn(CCCCOC)c2nccc(F)c12.CCc1cn(CCCCOC)c2ncccc12.CCc1cn(CCCNC(=O)OC)c2ncccc12.CCc1cn(CCCOC)c2nc(C)cc(Cl)c12.CCc1cn(CCCOC)c2nccc(-c3ccccc3)c12.CCc1cn(CCCOC)c2nccc(Br)c12.CCc1cn(CCCOC)c2nccc(C3CCCCC3)c12.

What is the InChIKey of 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate?

The InChIKey is GGGMTTWFGAYCMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H28N2O.C19H22N2O.C15H22N2O.2C14H19ClN2O.C14H19FN2O.C14H19N3O2.C14H20N2O.C13H17BrN2O/c2*1-3-15-14-21(12-7-13-22-2)19-18(15)17(10-11-20-19)16-8-5-4-6-9-16;1-4-13-11-17(9-5-6-10-18-3)15-14(13)8-7-12(2)16-15;1-4-11-9-17(6-5-7-18-3)14-13(11)12(15)8-10(2)16-14;2*1-3-11-10-17(8-4-5-9-18-2)14-13(11)12(15)6-7-16-14;1-3-11-10-17(9-5-8-16-14(18)19-2)13-12(11)6-4-7-15-13;1-3-12-11-16(9-4-5-10-17-2)14-13(12)7-6-8-15-14;1-3-10-9-16(7-4-8-17-2)13-12(10)11(14)5-6-15-13/h10-11,14,16H,3-9,12-13H2,1-2H3;4-6,8-11,14H,3,7,12-13H2,1-2H3;7-8,11H,4-6,9-10H2,1-3H3;8-9H,4-7H2,1-3H3;2*6-7,10H,3-5,8-9H2,1-2H3;4,6-7,10H,3,5,8-9H2,1-2H3,(H,16,18);6-8,11H,3-5,9-10H2,1-2H3;5-6,9H,3-4,7-8H2,1-2H3.

What are the key properties of 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate?

4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate has a molecular weight of 2415.91 g/mol, XLogP of 31.53, 51 rotatable bonds, 1 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 4-bromo-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;4-chloro-3-ethyl-1-(3-methoxypropyl)-6-methylpyrrolo[2,3-b]pyridine;4-cyclohexyl-3-ethyl-1-(3-methoxypropyl)pyrrolo[2,3-b]pyridine;3-ethyl-4-fluoro-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)-6-methylpyrrolo[2,3-b]pyridine;3-ethyl-1-(4-methoxybutyl)pyrrolo[2,3-b]pyridine;3-ethyl-1-(3-methoxypropyl)-4-phenylpyrrolo[2,3-b]pyridine;methyl N-[3-(3-ethylpyrrolo[2,3-b]pyridin-1-yl)propyl]carbamate is sourced from PubChem (CID 158247196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).