4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine

C40H28N2 — CID 67990612

IUPAC4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine
SMILESc1ccc(-c2cc(-c3ccccc3)c(-c3ccc(-c4ccncc4)cc3)cc2-c2ccc(-c3ccncc3)cc2)cc1
InChIInChI=1S/C40H28N2/c1-3-7-33(8-4-1)37-27-38(34-9-5-2-6-10-34)40(36-17-13-30(14-18-36)32-21-25-42-26-22-32)28-39(37)35-15-11-29(12-16-35)31-19-23-41-24-20-31/h1-28H
InChIKeyNLSGVCOSZJLUPT-UHFFFAOYSA-N
MW536.68 g/mol
LogP10.48
Rot. Bonds6

About 4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine

4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine (PubChem CID 67990612) has the molecular formula C40H28N2 and a molecular weight of 536.68 g/mol. Its IUPAC name is 4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine.

Molecular Properties

Compound Name4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine
PubChem CID67990612
Molecular FormulaC40H28N2
Molecular Weight536.68 g/mol
Exact Mass536.23
IUPAC Name4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine
SMILESc1ccc(-c2cc(-c3ccccc3)c(-c3ccc(-c4ccncc4)cc3)cc2-c2ccc(-c3ccncc3)cc2)cc1
InChIInChI=1S/C40H28N2/c1-3-7-33(8-4-1)37-27-38(34-9-5-2-6-10-34)40(36-17-13-30(14-18-36)32-21-25-42-26-22-32)28-39(37)35-15-11-29(12-16-35)31-19-23-41-24-20-31/h1-28H
InChIKeyNLSGVCOSZJLUPT-UHFFFAOYSA-N
XLogP10.48
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms42
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500536.68
LogP ≤ 510.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-[4-(3-phenylphenyl)phenyl]pyridine
CID 58943522
azane;4-phenylpyridine
CID 175775455
3-[4-[2,4-bis(4-phenylphenyl)-5-(4-pyridin-3-ylphenyl)phenyl]phenyl]pyridine
CID 67990643
2,6-diphenyl-4-pyridin-4-ylaniline
CID 11209480
2-[4-(2,5-diphenylphenyl)-3-phenylphenyl]-4,6-dipyridin-4-yl-1,3,5-triazine
CID 146187499
2,4-bis(4-phenylphenyl)-6-[3-(2-phenylphenyl)-5-pyridin-4-ylphenyl]-1,3,5-triazine
CID 155595102
bis(4-phenylpyridine);trichloroiridium
CID 58162878
4-(7-phenyl-3-pyridin-4-ylpyren-1-yl)pyridine
CID 58028964
2-phenyl-4-(4-pyridin-4-ylphenyl)-6-[4-(4-pyridin-4-ylphenyl)phenyl]pyrimidine
CID 121289840
4-(3-chloroazulen-1-yl)pyridine
CID 127025394
2,4-diphenyl-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(2-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(3-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(4-pyridin-4-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 167534445
ethanol;4-(2,4,5-tripyridin-4-ylphenyl)pyridine
CID 139144971

Frequently Asked Questions

What is the IUPAC name of 4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine?
The IUPAC name of 4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine (CID 67990612) is 4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine.
What is the SMILES notation for 4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine?
The canonical SMILES for 4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine is c1ccc(-c2cc(-c3ccccc3)c(-c3ccc(-c4ccncc4)cc3)cc2-c2ccc(-c3ccncc3)cc2)cc1.
What is the InChIKey of 4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine?
The InChIKey is NLSGVCOSZJLUPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C40H28N2/c1-3-7-33(8-4-1)37-27-38(34-9-5-2-6-10-34)40(36-17-13-30(14-18-36)32-21-25-42-26-22-32)28-39(37)35-15-11-29(12-16-35)31-19-23-41-24-20-31/h1-28H.
What are the key properties of 4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine?
4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine has a molecular weight of 536.68 g/mol, XLogP of 10.48, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[2,4-diphenyl-5-(4-pyridin-4-ylphenyl)phenyl]phenyl]pyridine is sourced from PubChem (CID 67990612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).