2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine

C55H37N — CID 135173134

IUPAC2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(-c4cccc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccccn5)c4)cc32)cc1
InChIInChI=1S/C55H37N/c1-4-20-41(21-5-1)54(42-22-6-2-7-23-42)48-29-12-10-26-45(48)46-34-33-39(37-51(46)54)38-18-16-19-40(36-38)44-28-17-31-50-53(44)47-27-11-13-30-49(47)55(50,43-24-8-3-9-25-43)52-32-14-15-35-56-52/h1-37H
InChIKeyTXRFIGUEUKPUCO-UHFFFAOYSA-N
MW711.91 g/mol
LogP13.14
Rot. Bonds6

About 2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine

2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine (PubChem CID 135173134) has the molecular formula C55H37N and a molecular weight of 711.91 g/mol. Its IUPAC name is 2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine.

Molecular Properties

Compound Name2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine
PubChem CID135173134
Molecular FormulaC55H37N
Molecular Weight711.91 g/mol
Exact Mass711.29
IUPAC Name2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(-c4cccc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccccn5)c4)cc32)cc1
InChIInChI=1S/C55H37N/c1-4-20-41(21-5-1)54(42-22-6-2-7-23-42)48-29-12-10-26-45(48)46-34-33-39(37-51(46)54)38-18-16-19-40(36-38)44-28-17-31-50-53(44)47-27-11-13-30-49(47)55(50,43-24-8-3-9-25-43)52-32-14-15-35-56-52/h1-37H
InChIKeyTXRFIGUEUKPUCO-UHFFFAOYSA-N
XLogP13.14
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms56
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500711.91
LogP ≤ 513.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4'-[3-[3-[3-[3-[3-(9,9-diphenylfluoren-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]-9,9'-spirobi[fluorene]
CID 177266011
4'-[3-[3-[3-[3-[3-(9,9-diphenylfluoren-2-yl)phenyl]phenyl]phenyl]phenyl]-5-phenylphenyl]-9,9'-spirobi[fluorene]
CID 177115837
4-[2-[3-[3-[3-[3-[3-phenyl-5-(9,9'-spirobi[fluorene]-4'-yl)phenyl]phenyl]phenyl]phenyl]phenyl]-9-pyridin-4-ylfluoren-9-yl]pyridine
CID 177115865
9,9-diphenyl-2-[3-(3-phenylphenyl)phenyl]fluorene
CID 154591168
7-[3-(9,9-diphenylfluoren-2-yl)phenyl]-4-phenyl-2-pyridin-2-ylquinoline;7-[4-(9,9-diphenylfluoren-2-yl)phenyl]-4-phenyl-2-pyridin-2-ylquinoline;7-[4-(9,9-diphenylfluoren-4-yl)phenyl]-4-phenyl-2-pyridin-2-ylquinoline;4-phenyl-2-pyridin-2-yl-6-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]quinoline;4-phenyl-2-pyridin-2-yl-6-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]quinoline;4-phenyl-2-pyridin-2-yl-6-[4-(9,9'-spirobi[fluorene]-4'-yl)phenyl]quinoline
CID 162102025
4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
CID 164785729
4'-[3-[3-[9-[3-[3-(9,9-dimethylfluoren-2-yl)phenyl]phenyl]fluoren-9-yl]phenyl]phenyl]-9,9'-spirobi[fluorene]
CID 140873469
2,4-diphenyl-6-(9-phenyl-9-pyridin-2-ylfluoren-3-yl)pyrimidine
CID 142384952
3-[3-[3-[3-(9,9-diphenylfluoren-2-yl)-5-[3-(3-pyridin-3-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
CID 164785730
2-(9,9-diphenylfluoren-2-yl)-4,6-diphenyl-1,3,5-triazine;2-(9,9-diphenylfluoren-2-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2-(9,9-diphenylfluoren-4-yl)-4-phenyl-6-(4-phenylphenyl)-1,3,5-triazine;2,4-diphenyl-6-(9,9'-spirobi[fluorene]-2-yl)-1,3,5-triazine
CID 160879933
2-[3-(3-naphthalen-1-ylphenyl)phenyl]-9,9-diphenylfluorene
CID 154591181
2-[3-(9,9-diphenylfluoren-2-yl)phenyl]-4-phenyl-6-[3-(4-phenylphenyl)phenyl]-1,3,5-triazine
CID 139521072

Frequently Asked Questions

What is the IUPAC name of 2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine?
The IUPAC name of 2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine (CID 135173134) is 2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine.
What is the SMILES notation for 2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine?
The canonical SMILES for 2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine is c1ccc(C2(c3ccccc3)c3ccccc3-c3ccc(-c4cccc(-c5cccc6c5-c5ccccc5C6(c5ccccc5)c5ccccn5)c4)cc32)cc1.
What is the InChIKey of 2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine?
The InChIKey is TXRFIGUEUKPUCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C55H37N/c1-4-20-41(21-5-1)54(42-22-6-2-7-23-42)48-29-12-10-26-45(48)46-34-33-39(37-51(46)54)38-18-16-19-40(36-38)44-28-17-31-50-53(44)47-27-11-13-30-49(47)55(50,43-24-8-3-9-25-43)52-32-14-15-35-56-52/h1-37H.
What are the key properties of 2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine?
2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine has a molecular weight of 711.91 g/mol, XLogP of 13.14, 6 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine is sourced from PubChem (CID 135173134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).