2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine

C30H20N6 — CID 11123456

IUPAC2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine
SMILESc1ccc(-c2cccc(-c3cccc(-c4cccc(-c5cccc(-c6ccccn6)n5)n4)n3)n2)nc1
InChIInChI=1S/C30H20N6/c1-3-19-31-21(9-1)23-11-5-13-25(33-23)27-15-7-17-29(35-27)30-18-8-16-28(36-30)26-14-6-12-24(34-26)22-10-2-4-20-32-22/h1-20H
InChIKeyQLHCXTDRHLNCEE-UHFFFAOYSA-N
MW464.53 g/mol
LogP6.39
Rot. Bonds5

About 2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine

2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine (PubChem CID 11123456) has the molecular formula C30H20N6 and a molecular weight of 464.53 g/mol. Its IUPAC name is 2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine.

Molecular Properties

Compound Name2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine
PubChem CID11123456
Molecular FormulaC30H20N6
Molecular Weight464.53 g/mol
Exact Mass464.17
IUPAC Name2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine
SMILESc1ccc(-c2cccc(-c3cccc(-c4cccc(-c5cccc(-c6ccccn6)n5)n4)n3)n2)nc1
InChIInChI=1S/C30H20N6/c1-3-19-31-21(9-1)23-11-5-13-25(33-23)27-15-7-17-29(35-27)30-18-8-16-28(36-30)26-14-6-12-24(34-26)22-10-2-4-20-32-22/h1-20H
InChIKeyQLHCXTDRHLNCEE-UHFFFAOYSA-N
XLogP6.39
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500464.53
LogP ≤ 56.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine?
The IUPAC name of 2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine (CID 11123456) is 2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine.
What is the SMILES notation for 2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine?
The canonical SMILES for 2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine is c1ccc(-c2cccc(-c3cccc(-c4cccc(-c5cccc(-c6ccccn6)n5)n4)n3)n2)nc1.
What is the InChIKey of 2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine?
The InChIKey is QLHCXTDRHLNCEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H20N6/c1-3-19-31-21(9-1)23-11-5-13-25(33-23)27-15-7-17-29(35-27)30-18-8-16-28(36-30)26-14-6-12-24(34-26)22-10-2-4-20-32-22/h1-20H.
What are the key properties of 2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine?
2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine has a molecular weight of 464.53 g/mol, XLogP of 6.39, 5 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyridin-2-yl-6-[6-[6-(6-pyridin-2-yl-2-pyridinyl)-2-pyridinyl]-2-pyridinyl]pyridine is sourced from PubChem (CID 11123456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).