2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine

C29H20FN — CID 171056482

IUPAC2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine
SMILESFc1cccc(-c2ccc(-c3ccc(-c4ccc(-c5ccccn5)cc4)cc3)cc2)c1
InChIInChI=1S/C29H20FN/c30-28-5-3-4-27(20-28)25-13-11-23(12-14-25)21-7-9-22(10-8-21)24-15-17-26(18-16-24)29-6-1-2-19-31-29/h1-20H
InChIKeyCYOZHPGECQTILB-UHFFFAOYSA-N
MW401.48 g/mol
LogP7.89
Rot. Bonds4

About 2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine

2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine (PubChem CID 171056482) has the molecular formula C29H20FN and a molecular weight of 401.48 g/mol. Its IUPAC name is 2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine.

Molecular Properties

Compound Name2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine
PubChem CID171056482
Molecular FormulaC29H20FN
Molecular Weight401.48 g/mol
Exact Mass401.16
IUPAC Name2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine
SMILESFc1cccc(-c2ccc(-c3ccc(-c4ccc(-c5ccccn5)cc4)cc3)cc2)c1
InChIInChI=1S/C29H20FN/c30-28-5-3-4-27(20-28)25-13-11-23(12-14-25)21-7-9-22(10-8-21)24-15-17-26(18-16-24)29-6-1-2-19-31-29/h1-20H
InChIKeyCYOZHPGECQTILB-UHFFFAOYSA-N
XLogP7.89
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500401.48
LogP ≤ 57.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

tris(2-[3-(3-fluorophenyl)phenyl]pyridine);iridium
CID 158235449
2-[4-[4-[4-(4-fluorophenyl)phenyl]phenyl]phenyl]pyridine
CID 171056601
2-[3-[4-[4-[3-[3-[3-[3-(3-phenylphenyl)phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]phenyl]pyridine
CID 171461302
trimethyl-[4-[3-(4-pyridin-2-ylphenyl)phenyl]phenyl]silane
CID 171056391
2-[3-(4-ethylphenyl)phenyl]pyridine
CID 151780746
bis(2-(4-fluorophenyl)pyridine);iridium(3+);trihexafluorophosphate
CID 175720169
2-[4-[2-[3,5-bis[5-fluoro-2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-3-(4-phenylphenyl)phenyl]pyridine
CID 153458373
5-[2-[3,5-bis[2-(4-pyridin-2-ylphenyl)phenyl]phenyl]phenyl]-2-[3-(4-phenylphenyl)phenyl]pyridine
CID 153458177
22-(3-pyridin-2-ylphenyl)-52,55-diazatridecacyclo[41.8.4.22,5.211,14.230,33.239,42.16,10.115,19.120,24.125,29.134,38.046,54.049,53]octahexaconta-1(52),2(68),3,5(67),6,8,10(66),11(65),12,14(64),15(63),16,18,20(62),21,23,25,27,29(61),30,32,34(58),35,37,39,41,43(55),44,46(54),47,49(53),50,56,59-tetratriacontaene
CID 140920150
hydrazine;2-phenylpyridine
CID 158673997
1-fluoro-3-phenylbenzene;phosphane;hydrochloride
CID 175120364
1-(3-fluorophenyl)-3,5-diphenylbenzene
CID 141411457

Frequently Asked Questions

What is the IUPAC name of 2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine?
The IUPAC name of 2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine (CID 171056482) is 2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine.
What is the SMILES notation for 2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine?
The canonical SMILES for 2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine is Fc1cccc(-c2ccc(-c3ccc(-c4ccc(-c5ccccn5)cc4)cc3)cc2)c1.
What is the InChIKey of 2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine?
The InChIKey is CYOZHPGECQTILB-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H20FN/c30-28-5-3-4-27(20-28)25-13-11-23(12-14-25)21-7-9-22(10-8-21)24-15-17-26(18-16-24)29-6-1-2-19-31-29/h1-20H.
What are the key properties of 2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine?
2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine has a molecular weight of 401.48 g/mol, XLogP of 7.89, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[4-[4-(3-fluorophenyl)phenyl]phenyl]phenyl]pyridine is sourced from PubChem (CID 171056482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).