tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine

C89H129N13O9Si3 — CID 123163399

About tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine

tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine (PubChem CID 123163399) has the molecular formula C89H129N13O9Si3 and a molecular weight of 1609.35 g/mol. Its IUPAC name is tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine.

Molecular Properties

• Compound Name: tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine
• PubChem CID: 123163399
• Molecular Formula: C89H129N13O9Si3
• Molecular Weight: 1609.35 g/mol
• Exact Mass: 1607.93
• IUPAC Name: tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine
• SMILES: CC(C)(C)OC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1.CC(C)(C)OC(=O)N1CC=C(c2cn(COCC[Si](C)(C)C)c3ncccc23)CC1.CC(C)(C)OC(=O)N1CCC(c2cn(COCC[Si](C)(C)C)c3ncccc23)CC1.C[Si](C)(C)CCOCn1cc(C2CCCCC2)c2cccnc21.c1cnc2[nH]ccc2c1
• InChI: InChI=1S/C23H37N3O3Si.C23H35N3O3Si.C19H30N2OSi.C17H21N3O2.C7H6N2/c2*1-23(2,3)29-22(27)25-12-9-18(10-13-25)20-16-26(17-28-14-15-30(4,5)6)21-19(20)8-7-11-24-21;1-23(2,3)13-12-22-15-21-14-18(16-8-5-4-6-9-16)17-10-7-11-20-19(17)21;1-17(2,3)22-16(21)20-9-6-12(7-10-20)14-11-19-15-13(14)5-4-8-18-15;1-2-6-3-5-9-7(6)8-4-1/h7-8,11,16,18H,9-10,12-15,17H2,1-6H3;7-9,11,16H,10,12-15,17H2,1-6H3;7,10-11,14,16H,4-6,8-9,12-13,15H2,1-3H3;4-6,8,11H,7,9-10H2,1-3H3,(H,18,19);1-5H,(H,8,9)
• InChIKey: OHRMNEOJQXVPFX-UHFFFAOYSA-N
• XLogP: 21.38
• TPSA: 227.13 Ų
• H-Bond Donors: 2
• H-Bond Acceptors: 17
• Rotatable Bonds: 19
• Heavy Atoms: 114
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1609.35
LogP ≤ 5	21.38
H-Bond Donors ≤ 5	2
H-Bond Acceptors ≤ 10	17

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine?

The IUPAC name of tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine (CID 123163399) is tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine.

What is the SMILES notation for tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine?

The canonical SMILES for tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine is CC(C)(C)OC(=O)N1CC=C(c2c[nH]c3ncccc23)CC1.CC(C)(C)OC(=O)N1CC=C(c2cn(COCC[Si](C)(C)C)c3ncccc23)CC1.CC(C)(C)OC(=O)N1CCC(c2cn(COCC[Si](C)(C)C)c3ncccc23)CC1.C[Si](C)(C)CCOCn1cc(C2CCCCC2)c2cccnc21.c1cnc2[nH]ccc2c1.

What is the InChIKey of tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine?

The InChIKey is OHRMNEOJQXVPFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H37N3O3Si.C23H35N3O3Si.C19H30N2OSi.C17H21N3O2.C7H6N2/c2*1-23(2,3)29-22(27)25-12-9-18(10-13-25)20-16-26(17-28-14-15-30(4,5)6)21-19(20)8-7-11-24-21;1-23(2,3)13-12-22-15-21-14-18(16-8-5-4-6-9-16)17-10-7-11-20-19(17)21;1-17(2,3)22-16(21)20-9-6-12(7-10-20)14-11-19-15-13(14)5-4-8-18-15;1-2-6-3-5-9-7(6)8-4-1/h7-8,11,16,18H,9-10,12-15,17H2,1-6H3;7-9,11,16H,10,12-15,17H2,1-6H3;7,10-11,14,16H,4-6,8-9,12-13,15H2,1-3H3;4-6,8,11H,7,9-10H2,1-3H3,(H,18,19);1-5H,(H,8,9).

What are the key properties of tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine?

tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine has a molecular weight of 1609.35 g/mol, XLogP of 21.38, 19 rotatable bonds, 2 hydrogen bond donors, and 17 hydrogen bond acceptors.

Where does this data come from?

All data for tert-butyl 4-(1H-pyrrolo[2,3-b]pyridin-3-yl)-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]-3,6-dihydro-2H-pyridine-1-carboxylate;tert-butyl 4-[1-(2-trimethylsilylethoxymethyl)pyrrolo[2,3-b]pyridin-3-yl]piperidine-1-carboxylate;2-[(3-cyclohexylpyrrolo[2,3-b]pyridin-1-yl)methoxy]ethyl-trimethylsilane;1H-pyrrolo[2,3-b]pyridine is sourced from PubChem (CID 123163399), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).