5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole

C189H128N20 — CID 158711493

About 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole

5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole (PubChem CID 158711493) has the molecular formula C189H128N20 and a molecular weight of 2679.24 g/mol. Its IUPAC name is 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole.

Molecular Properties

• Compound Name: 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole
• PubChem CID: 158711493
• Molecular Formula: C189H128N20
• Molecular Weight: 2679.24 g/mol
• Exact Mass: 2677.06
• IUPAC Name: 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole
• SMILES: CCCCc1cc(-c2cccc(-c3cccc4ccccc34)c2)nc(-c2cccc(-n3c4ccccc4c4ncccc43)n2)c1.c1cc(-c2cccc(-c3cccc(-n4c5ccccc5c5ccncc54)n3)n2)cc(-c2cccc3ccccc23)c1.c1cc(-c2cccc(-c3cccc(-n4c5ccccc5c5cnccc54)n3)n2)cc(-c2cccc3ccccc23)c1.c1cc(-c2cccc(-n3c4ccccc4c4cnccc43)n2)nc(-c2ccccc2-c2ccc3ccccc3c2)c1.c1cc(-c2cccc(-n3c4ccccc4c4ncccc43)n2)nc(-c2ccccc2-c2ccc3ccccc3c2)c1
• InChI: InChI=1S/C41H32N4.4C37H24N4/c1-2-3-12-28-25-36(31-16-8-15-30(27-31)33-19-9-14-29-13-4-5-17-32(29)33)43-37(26-28)35-20-10-23-40(44-35)45-38-21-7-6-18-34(38)41-39(45)22-11-24-42-41;1-2-13-28-25(9-1)10-6-15-29(28)26-11-5-12-27(23-26)32-16-7-17-33(39-32)34-18-8-20-37(40-34)41-35-19-4-3-14-30(35)31-24-38-22-21-36(31)41;1-2-13-28-25(9-1)10-6-15-29(28)26-11-5-12-27(23-26)32-16-7-17-33(39-32)34-18-8-20-37(40-34)41-35-19-4-3-14-30(35)31-21-22-38-24-36(31)41;1-2-11-26-24-27(22-21-25(26)10-1)28-12-3-4-13-29(28)31-15-7-16-32(39-31)33-17-8-20-36(40-33)41-34-18-6-5-14-30(34)37-35(41)19-9-23-38-37;1-2-10-26-23-27(20-19-25(26)9-1)28-11-3-4-12-29(28)32-14-7-15-33(39-32)34-16-8-18-37(40-34)41-35-17-6-5-13-30(35)31-24-38-22-21-36(31)41/h4-11,13-27H,2-3,12H2,1H3;4*1-24H
• InChIKey: IITYRYGCRQIZBN-UHFFFAOYSA-N
• XLogP: 46.96
• TPSA: 218.00 Ų
• H-Bond Acceptors: 20
• Rotatable Bonds: 23
• Heavy Atoms: 209
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2679.24
LogP ≤ 5	46.96
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	20

Frequently Asked Questions

What is the IUPAC name of 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole?

The IUPAC name of 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole (CID 158711493) is 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole.

What is the SMILES notation for 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole?

The canonical SMILES for 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole is CCCCc1cc(-c2cccc(-c3cccc4ccccc34)c2)nc(-c2cccc(-n3c4ccccc4c4ncccc43)n2)c1.c1cc(-c2cccc(-c3cccc(-n4c5ccccc5c5ccncc54)n3)n2)cc(-c2cccc3ccccc23)c1.c1cc(-c2cccc(-c3cccc(-n4c5ccccc5c5cnccc54)n3)n2)cc(-c2cccc3ccccc23)c1.c1cc(-c2cccc(-n3c4ccccc4c4cnccc43)n2)nc(-c2ccccc2-c2ccc3ccccc3c2)c1.c1cc(-c2cccc(-n3c4ccccc4c4ncccc43)n2)nc(-c2ccccc2-c2ccc3ccccc3c2)c1.

What is the InChIKey of 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole?

The InChIKey is IITYRYGCRQIZBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H32N4.4C37H24N4/c1-2-3-12-28-25-36(31-16-8-15-30(27-31)33-19-9-14-29-13-4-5-17-32(29)33)43-37(26-28)35-20-10-23-40(44-35)45-38-21-7-6-18-34(38)41-39(45)22-11-24-42-41;1-2-13-28-25(9-1)10-6-15-29(28)26-11-5-12-27(23-26)32-16-7-17-33(39-32)34-18-8-20-37(40-34)41-35-19-4-3-14-30(35)31-24-38-22-21-36(31)41;1-2-13-28-25(9-1)10-6-15-29(28)26-11-5-12-27(23-26)32-16-7-17-33(39-32)34-18-8-20-37(40-34)41-35-19-4-3-14-30(35)31-21-22-38-24-36(31)41;1-2-11-26-24-27(22-21-25(26)10-1)28-12-3-4-13-29(28)31-15-7-16-32(39-31)33-17-8-20-36(40-33)41-34-18-6-5-14-30(34)37-35(41)19-9-23-38-37;1-2-10-26-23-27(20-19-25(26)9-1)28-11-3-4-12-29(28)32-14-7-15-33(39-32)34-16-8-18-37(40-34)41-35-17-6-5-13-30(35)31-24-38-22-21-36(31)41/h4-11,13-27H,2-3,12H2,1H3;4*1-24H.

What are the key properties of 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole?

5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole has a molecular weight of 2679.24 g/mol, XLogP of 46.96, 23 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[6-[4-butyl-6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,2-b]indole;5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;5-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole;9-[6-[6-(3-naphthalen-1-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[3,4-b]indole is sourced from PubChem (CID 158711493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).