4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine

C65H44N2 — CID 164785729

IUPAC4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3c(-c4cc(-c5cccc(-c6cccc(-c7ccncc7)c6)c5)cc(-c5cccc(-c6cccc(-c7ccncc7)c6)c5)c4)cccc32)cc1
InChIInChI=1S/C65H44N2/c1-3-22-58(23-4-1)65(59-24-5-2-6-25-59)62-28-8-7-26-61(62)64-60(27-13-29-63(64)65)57-43-55(53-20-11-18-51(40-53)49-16-9-14-47(38-49)45-30-34-66-35-31-45)42-56(44-57)54-21-12-19-52(41-54)50-17-10-15-48(39-50)46-32-36-67-37-33-46/h1-44H
InChIKeyACNIVKSTCLHQSL-UHFFFAOYSA-N
MW853.08 g/mol
LogP16.51
Rot. Bonds9

About 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine

4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine (PubChem CID 164785729) has the molecular formula C65H44N2 and a molecular weight of 853.08 g/mol. Its IUPAC name is 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine.

Molecular Properties

Compound Name4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
PubChem CID164785729
Molecular FormulaC65H44N2
Molecular Weight853.08 g/mol
Exact Mass852.35
IUPAC Name4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine
SMILESc1ccc(C2(c3ccccc3)c3ccccc3-c3c(-c4cc(-c5cccc(-c6cccc(-c7ccncc7)c6)c5)cc(-c5cccc(-c6cccc(-c7ccncc7)c6)c5)c4)cccc32)cc1
InChIInChI=1S/C65H44N2/c1-3-22-58(23-4-1)65(59-24-5-2-6-25-59)62-28-8-7-26-61(62)64-60(27-13-29-63(64)65)57-43-55(53-20-11-18-51(40-53)49-16-9-14-47(38-49)45-30-34-66-35-31-45)42-56(44-57)54-21-12-19-52(41-54)50-17-10-15-48(39-50)46-32-36-67-37-33-46/h1-44H
InChIKeyACNIVKSTCLHQSL-UHFFFAOYSA-N
XLogP16.51
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds9
Heavy Atoms67
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500853.08
LogP ≤ 516.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine with MolForge

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Related Compounds

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
4'-[3-[3-[3-[3-[3-(9,9-diphenylfluoren-2-yl)phenyl]phenyl]phenyl]phenyl]-5-phenylphenyl]-9,9'-spirobi[fluorene]
CID 177115837
2-(3-phenylphenyl)-4-pyridin-4-yl-6-[3-(9,9'-spirobi[fluorene]-4'-yl)phenyl]-1,3,5-triazine
CID 146632404
4'-[3,5-bis[4-(3,5-diphenylphenyl)phenyl]phenyl]-9,9'-spirobi[fluorene]
CID 166563560
4'-[3-[3-[3-[3-[3-(9,9-diphenylfluoren-2-yl)phenyl]phenyl]phenyl]phenyl]phenyl]-9,9'-spirobi[fluorene]
CID 177266011
2-[3-(7,7-diphenylbenzo[c]fluoren-5-yl)-5-pyridin-4-ylphenyl]-4,6-diphenylpyridine
CID 122431228
2,4-bis(3-phenylphenyl)-6-(9-phenyl-9-pyridin-4-ylfluoren-2-yl)pyridine
CID 142385097
2,4-diphenyl-6-[3-[6-(9-phenyl-9-pyridin-4-ylfluoren-4-yl)-2-pyridinyl]phenyl]-1,3,5-triazine
CID 142385297
9-(3-chlorophenyl)-4,9-diphenylfluorene
CID 176760005
2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine
CID 135173134
2,4-diphenyl-6-[3-[3-(9-phenyl-9-pyridin-3-ylfluoren-4-yl)phenyl]phenyl]pyrimidine
CID 142385241
9,9-bis[3-(3-phenylphenyl)phenyl]fluorene
CID 140873482

Frequently Asked Questions

What is the IUPAC name of 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine?
The IUPAC name of 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine (CID 164785729) is 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine.
What is the SMILES notation for 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine?
The canonical SMILES for 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine is c1ccc(C2(c3ccccc3)c3ccccc3-c3c(-c4cc(-c5cccc(-c6cccc(-c7ccncc7)c6)c5)cc(-c5cccc(-c6cccc(-c7ccncc7)c6)c5)c4)cccc32)cc1.
What is the InChIKey of 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine?
The InChIKey is ACNIVKSTCLHQSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C65H44N2/c1-3-22-58(23-4-1)65(59-24-5-2-6-25-59)62-28-8-7-26-61(62)64-60(27-13-29-63(64)65)57-43-55(53-20-11-18-51(40-53)49-16-9-14-47(38-49)45-30-34-66-35-31-45)42-56(44-57)54-21-12-19-52(41-54)50-17-10-15-48(39-50)46-32-36-67-37-33-46/h1-44H.
What are the key properties of 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine?
4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine has a molecular weight of 853.08 g/mol, XLogP of 16.51, 9 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-[3-[3-(9,9-diphenylfluoren-4-yl)-5-[3-(3-pyridin-4-ylphenyl)phenyl]phenyl]phenyl]phenyl]pyridine is sourced from PubChem (CID 164785729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).