3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide

C174H129N15O8 — CID 158767656

About 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide

3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide (PubChem CID 158767656) has the molecular formula C174H129N15O8 and a molecular weight of 2558.04 g/mol. Its IUPAC name is 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide.

Molecular Properties

• Compound Name: 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide
• PubChem CID: 158767656
• Molecular Formula: C174H129N15O8
• Molecular Weight: 2558.04 g/mol
• Exact Mass: 2556.01
• IUPAC Name: 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide
• SMILES: COc1ccc(-c2c[nH]c3ncc(-c4ccccc4)cc23)cc1.COc1cccc(-c2c[nH]c3ncc(-c4ccccc4)cc23)c1.Cc1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.O=C(Nc1ccccc1)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.c1ccc(-c2cnc3[nH]cc(-c4cccc5c4oc4ccccc45)c3c2)cc1.c1ccc(OCc2ccccc2-c2c[nH]c3ncc(-c4ccccc4)cc23)cc1.c1ccc(Oc2ccc(-c3c[nH]c4ncc(-c5ccccc5)cc34)cc2)cc1
• InChI: InChI=1S/C32H23N3O2.2C26H20N2O.C25H16N2O.C25H18N2O.2C20H16N2O/c36-32(35-25-9-3-1-4-10-25)23-17-15-22(16-18-23)29-21-34-31-28(29)19-24(20-33-31)27-13-7-8-14-30(27)37-26-11-5-2-6-12-26;1-18-11-13-19(14-12-18)24-17-28-26-23(24)15-20(16-27-26)22-9-5-6-10-25(22)29-21-7-3-2-4-8-21;1-3-9-19(10-4-1)21-15-24-25(17-28-26(24)27-16-21)23-14-8-7-11-20(23)18-29-22-12-5-2-6-13-22;1-2-7-16(8-3-1)17-13-21-22(15-27-25(21)26-14-17)20-11-6-10-19-18-9-4-5-12-23(18)28-24(19)20;1-3-7-18(8-4-1)20-15-23-24(17-27-25(23)26-16-20)19-11-13-22(14-12-19)28-21-9-5-2-6-10-21;1-23-17-9-5-8-15(10-17)19-13-22-20-18(19)11-16(12-21-20)14-6-3-2-4-7-14;1-23-17-9-7-15(8-10-17)19-13-22-20-18(19)11-16(12-21-20)14-5-3-2-4-6-14/h1-21H,(H,33,34)(H,35,36);2-17H,1H3,(H,27,28);1-17H,18H2,(H,27,28);1-15H,(H,26,27);1-17H,(H,26,27);2*2-13H,1H3,(H,21,22)
• InChIKey: IPLQTTDRZFLOOO-UHFFFAOYSA-N
• XLogP: 44.71
• TPSA: 298.38 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 15
• Rotatable Bonds: 27
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2558.04
LogP ≤ 5	44.71
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	15

Frequently Asked Questions

What is the IUPAC name of 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide?

The IUPAC name of 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide (CID 158767656) is 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide.

What is the SMILES notation for 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide?

The canonical SMILES for 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide is COc1ccc(-c2c[nH]c3ncc(-c4ccccc4)cc23)cc1.COc1cccc(-c2c[nH]c3ncc(-c4ccccc4)cc23)c1.Cc1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.O=C(Nc1ccccc1)c1ccc(-c2c[nH]c3ncc(-c4ccccc4Oc4ccccc4)cc23)cc1.c1ccc(-c2cnc3[nH]cc(-c4cccc5c4oc4ccccc45)c3c2)cc1.c1ccc(OCc2ccccc2-c2c[nH]c3ncc(-c4ccccc4)cc23)cc1.c1ccc(Oc2ccc(-c3c[nH]c4ncc(-c5ccccc5)cc34)cc2)cc1.

What is the InChIKey of 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide?

The InChIKey is IPLQTTDRZFLOOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C32H23N3O2.2C26H20N2O.C25H16N2O.C25H18N2O.2C20H16N2O/c36-32(35-25-9-3-1-4-10-25)23-17-15-22(16-18-23)29-21-34-31-28(29)19-24(20-33-31)27-13-7-8-14-30(27)37-26-11-5-2-6-12-26;1-18-11-13-19(14-12-18)24-17-28-26-23(24)15-20(16-27-26)22-9-5-6-10-25(22)29-21-7-3-2-4-8-21;1-3-9-19(10-4-1)21-15-24-25(17-28-26(24)27-16-21)23-14-8-7-11-20(23)18-29-22-12-5-2-6-13-22;1-2-7-16(8-3-1)17-13-21-22(15-27-25(21)26-14-17)20-11-6-10-19-18-9-4-5-12-23(18)28-24(19)20;1-3-7-18(8-4-1)20-15-23-24(17-27-25(23)26-16-20)19-11-13-22(14-12-19)28-21-9-5-2-6-10-21;1-23-17-9-5-8-15(10-17)19-13-22-20-18(19)11-16(12-21-20)14-6-3-2-4-7-14;1-23-17-9-7-15(8-10-17)19-13-22-20-18(19)11-16(12-21-20)14-5-3-2-4-6-14/h1-21H,(H,33,34)(H,35,36);2-17H,1H3,(H,27,28);1-17H,18H2,(H,27,28);1-15H,(H,26,27);1-17H,(H,26,27);2*2-13H,1H3,(H,21,22).

What are the key properties of 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide?

3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide has a molecular weight of 2558.04 g/mol, XLogP of 44.71, 27 rotatable bonds, 8 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 3-dibenzofuran-4-yl-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(3-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-methylphenyl)-5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridine;3-[2-(phenoxymethyl)phenyl]-5-phenyl-1H-pyrrolo[2,3-b]pyridine;3-(4-phenoxyphenyl)-5-phenyl-1H-pyrrolo[2,3-b]pyridine;4-[5-(2-phenoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-3-yl]-N-phenylbenzamide is sourced from PubChem (CID 158767656), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).