diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid

C137H146N20O19 — CID 159560307

About diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid

diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid (PubChem CID 159560307) has the molecular formula C137H146N20O19 and a molecular weight of 2376.80 g/mol. Its IUPAC name is diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid.

Molecular Properties

• Compound Name: diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid
• PubChem CID: 159560307
• Molecular Formula: C137H146N20O19
• Molecular Weight: 2376.80 g/mol
• Exact Mass: 2375.11
• IUPAC Name: diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid
• SMILES: CCOC(=O)C(C(=O)OCC)C(c1ccccc1)c1c[nH]c2nccc(OC)c12.CNC(=O)CC(c1ccccc1)c1c[nH]c2nccc(OC)c12.CNCCC(c1ccccc1)c1c[nH]c2nccc(OC)c12.CNCC[C@@H](c1ccccc1)c1c[nH]c2nccc(OC)c12.CNCC[C@H](c1ccccc1)c1c[nH]c2nccc(OC)c12.COc1ccnc2[nH]cc(C(CC(=O)O)c3ccccc3)c12.COc1ccnc2[nH]cc(C(c3ccccc3)C(C(=O)O)C(=O)O)c12.COc1ccnc2[nH]ccc12
• InChI: InChI=1S/C22H24N2O5.C18H19N3O2.3C18H21N3O.C18H16N2O5.C17H16N2O3.C8H8N2O/c1-4-28-21(25)19(22(26)29-5-2)17(14-9-7-6-8-10-14)15-13-24-20-18(15)16(27-3)11-12-23-20;1-19-16(22)10-13(12-6-4-3-5-7-12)14-11-21-18-17(14)15(23-2)8-9-20-18;3*1-19-10-8-14(13-6-4-3-5-7-13)15-12-21-18-17(15)16(22-2)9-11-20-18;1-25-12-7-8-19-16-14(12)11(9-20-16)13(10-5-3-2-4-6-10)15(17(21)22)18(23)24;1-22-14-7-8-18-17-16(14)13(10-19-17)12(9-15(20)21)11-5-3-2-4-6-11;1-11-7-3-5-10-8-6(7)2-4-9-8/h6-13,17,19H,4-5H2,1-3H3,(H,23,24);3-9,11,13H,10H2,1-2H3,(H,19,22)(H,20,21);3*3-7,9,11-12,14,19H,8,10H2,1-2H3,(H,20,21);2-9,13,15H,1H3,(H,19,20)(H,21,22)(H,23,24);2-8,10,12H,9H2,1H3,(H,18,19)(H,20,21);2-5H,1H3,(H,9,10)/t;;2*14-;;;;/m..10..../s1
• InChIKey: MGNFANBZYFYUMG-KVXGNQICSA-N
• XLogP: 23.46
• TPSA: 532.97 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 27
• Rotatable Bonds: 43
• Heavy Atoms: 176
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2376.80
LogP ≤ 5	23.46
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	27

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid?

The IUPAC name of diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid (CID 159560307) is diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid.

What is the SMILES notation for diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid?

The canonical SMILES for diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid is CCOC(=O)C(C(=O)OCC)C(c1ccccc1)c1c[nH]c2nccc(OC)c12.CNC(=O)CC(c1ccccc1)c1c[nH]c2nccc(OC)c12.CNCCC(c1ccccc1)c1c[nH]c2nccc(OC)c12.CNCC[C@@H](c1ccccc1)c1c[nH]c2nccc(OC)c12.CNCC[C@H](c1ccccc1)c1c[nH]c2nccc(OC)c12.COc1ccnc2[nH]cc(C(CC(=O)O)c3ccccc3)c12.COc1ccnc2[nH]cc(C(c3ccccc3)C(C(=O)O)C(=O)O)c12.COc1ccnc2[nH]ccc12.

What is the InChIKey of diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid?

The InChIKey is MGNFANBZYFYUMG-KVXGNQICSA-N. The full InChI is InChI=1S/C22H24N2O5.C18H19N3O2.3C18H21N3O.C18H16N2O5.C17H16N2O3.C8H8N2O/c1-4-28-21(25)19(22(26)29-5-2)17(14-9-7-6-8-10-14)15-13-24-20-18(15)16(27-3)11-12-23-20;1-19-16(22)10-13(12-6-4-3-5-7-12)14-11-21-18-17(14)15(23-2)8-9-20-18;3*1-19-10-8-14(13-6-4-3-5-7-13)15-12-21-18-17(15)16(22-2)9-11-20-18;1-25-12-7-8-19-16-14(12)11(9-20-16)13(10-5-3-2-4-6-10)15(17(21)22)18(23)24;1-22-14-7-8-18-17-16(14)13(10-19-17)12(9-15(20)21)11-5-3-2-4-6-11;1-11-7-3-5-10-8-6(7)2-4-9-8/h6-13,17,19H,4-5H2,1-3H3,(H,23,24);3-9,11,13H,10H2,1-2H3,(H,19,22)(H,20,21);3*3-7,9,11-12,14,19H,8,10H2,1-2H3,(H,20,21);2-9,13,15H,1H3,(H,19,20)(H,21,22)(H,23,24);2-8,10,12H,9H2,1H3,(H,18,19)(H,20,21);2-5H,1H3,(H,9,10)/t;;2*14-;;;;/m..10..../s1.

What are the key properties of diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid?

diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid has a molecular weight of 2376.80 g/mol, XLogP of 23.46, 43 rotatable bonds, 15 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for diethyl 2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioate;4-methoxy-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropanamide;(3S)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;(3R)-3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-N-methyl-3-phenylpropan-1-amine;2-[(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-phenylmethyl]propanedioic acid;3-(4-methoxy-1H-pyrrolo[2,3-b]pyridin-3-yl)-3-phenylpropanoic acid is sourced from PubChem (CID 159560307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).