4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine

C43H29N5 — CID 118582537

IUPAC4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine
SMILESc1ccc(-c2ccc(-c3cc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)cc(-c4ccc(-c5ccccn5)cc4)n3)cc2)nc1
InChIInChI=1S/C43H29N5/c1-5-21-44-38(9-1)30-13-17-32(18-14-30)42-28-35(29-43(48-42)33-19-15-31(16-20-33)39-10-2-6-22-45-39)34-25-36(40-11-3-7-23-46-40)27-37(26-34)41-12-4-8-24-47-41/h1-29H
InChIKeyMOTNRKXJXQGFDR-UHFFFAOYSA-N
MW615.74 g/mol
LogP10.33
Rot. Bonds7

About 4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine

4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine (PubChem CID 118582537) has the molecular formula C43H29N5 and a molecular weight of 615.74 g/mol. Its IUPAC name is 4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine.

Molecular Properties

Compound Name4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine
PubChem CID118582537
Molecular FormulaC43H29N5
Molecular Weight615.74 g/mol
Exact Mass615.24
IUPAC Name4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine
SMILESc1ccc(-c2ccc(-c3cc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)cc(-c4ccc(-c5ccccn5)cc4)n3)cc2)nc1
InChIInChI=1S/C43H29N5/c1-5-21-44-38(9-1)30-13-17-32(18-14-30)42-28-35(29-43(48-42)33-19-15-31(16-20-33)39-10-2-6-22-45-39)34-25-36(40-11-3-7-23-46-40)27-37(26-34)41-12-4-8-24-47-41/h1-29H
InChIKeyMOTNRKXJXQGFDR-UHFFFAOYSA-N
XLogP10.33
TPSA64.45 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms48
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500615.74
LogP ≤ 510.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

4-(3,5-dipyridin-2-ylphenyl)-2-phenyl-6-pyridin-2-ylpyridine
CID 23528039
2,6-diphenyl-4-[3-(3-pyridin-2-ylphenyl)phenyl]pyridine
CID 140587116
2-phenyl-4,6-bis[3-phenyl-5-(4-pyridin-2-ylphenyl)phenyl]pyrimidine
CID 134166118
2,6-dipyridin-2-yl-4-[4-[3-pyridin-2-yl-5-(6-pyridin-2-yl-3-pyridinyl)phenyl]phenyl]pyridine
CID 126730919
4-(4-bromophenyl)-2-phenyl-6-(4-pyridin-2-ylphenyl)pyridine
CID 130238337
2-(3,5-dipyridin-2-ylphenyl)-4,6-bis(4-pyridin-2-ylphenyl)-1,3,5-triazine
CID 118582359
4,6-diphenyl-2-[3-(4-phenylphenyl)-5-(4-pyridin-2-ylphenyl)phenyl]pyrimidine
CID 122549117
2-[3,5-bis[6-(3-pyridin-2-ylphenyl)-2-pyridinyl]phenyl]-6-(3-pyridin-2-ylphenyl)pyridine
CID 102128660
6-[4-(4-pyridin-2-ylphenyl)-6-quinolin-6-yl-2-pyridinyl]quinoline
CID 122416232
2-[3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-5-[2-phenyl-6-(4-phenylphenyl)pyrimidin-4-yl]phenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 126730905
4-[10-(2,6-dipyridin-2-yl-4-pyridinyl)anthracen-9-yl]-2,6-dipyridin-2-ylpyridine;4-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-2,6-dipyridin-2-ylpyridine;2,4,6-tripyridin-2-ylpyridine
CID 161380228
2-[3-[4-(2,6-dipyridin-2-yl-4-pyridinyl)phenyl]-5-pyridin-2-ylphenyl]-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine
CID 126730883

Frequently Asked Questions

What is the IUPAC name of 4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine?
The IUPAC name of 4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine (CID 118582537) is 4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine.
What is the SMILES notation for 4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine?
The canonical SMILES for 4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine is c1ccc(-c2ccc(-c3cc(-c4cc(-c5ccccn5)cc(-c5ccccn5)c4)cc(-c4ccc(-c5ccccn5)cc4)n3)cc2)nc1.
What is the InChIKey of 4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine?
The InChIKey is MOTNRKXJXQGFDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C43H29N5/c1-5-21-44-38(9-1)30-13-17-32(18-14-30)42-28-35(29-43(48-42)33-19-15-31(16-20-33)39-10-2-6-22-45-39)34-25-36(40-11-3-7-23-46-40)27-37(26-34)41-12-4-8-24-47-41/h1-29H.
What are the key properties of 4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine?
4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine has a molecular weight of 615.74 g/mol, XLogP of 10.33, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,5-dipyridin-2-ylphenyl)-2,6-bis(4-pyridin-2-ylphenyl)pyridine is sourced from PubChem (CID 118582537), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).