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

C37H24N4 — CID 59480434

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

5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole (PubChem CID 59480434) has the molecular formula C37H24N4 and a molecular weight of 524.63 g/mol. Its IUPAC name is 5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole.

Molecular Properties

• Compound Name: 5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole
• PubChem CID: 59480434
• Molecular Formula: C37H24N4
• Molecular Weight: 524.63 g/mol
• Exact Mass: 524.20
• IUPAC Name: 5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole
• SMILES: c1cc(-c2cccc(-n3c4ccccc4c4cnccc43)n2)nc(-c2ccccc2-c2ccc3ccccc3c2)c1
• InChI: InChI=1S/C37H24N4/c1-2-10-26-23-27(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/h1-24H
• InChIKey: SGJVZGGFHQPQFA-UHFFFAOYSA-N
• XLogP: 9.12
• TPSA: 43.60 Ų
• H-Bond Acceptors: 4
• Rotatable Bonds: 4
• Heavy Atoms: 41
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	524.63
LogP ≤ 5	9.12
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	4

Frequently Asked Questions

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

The IUPAC name of 5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole (CID 59480434) is 5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole.

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

The canonical SMILES for 5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole is c1cc(-c2cccc(-n3c4ccccc4c4cnccc43)n2)nc(-c2ccccc2-c2ccc3ccccc3c2)c1.

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

The InChIKey is SGJVZGGFHQPQFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C37H24N4/c1-2-10-26-23-27(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/h1-24H.

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

5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole has a molecular weight of 524.63 g/mol, XLogP of 9.12, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[6-[6-(2-naphthalen-2-ylphenyl)-2-pyridinyl]-2-pyridinyl]pyrido[4,3-b]indole is sourced from PubChem (CID 59480434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).