2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine

C58H37N — CID 165152302

IUPAC2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine
SMILESc1ccc(-c2cccc(-c3cc(-c4cccc(-c5cc6ccccc6c6c5-c5ccccc5C65c6ccccc6-c6ccccc65)c4)cc(-c4ccccc4)n3)c2)cc1
InChIInChI=1S/C58H37N/c1-3-17-38(18-4-1)40-22-16-25-44(34-40)55-37-45(36-54(59-55)39-19-5-2-6-20-39)41-23-15-24-42(33-41)50-35-43-21-7-8-26-46(43)57-56(50)49-29-11-14-32-53(49)58(57)51-30-12-9-27-47(51)48-28-10-13-31-52(48)58/h1-37H
InChIKeyRETZYDDLFMOIDR-UHFFFAOYSA-N
MW747.94 g/mol
LogP14.91
Rot. Bonds5

About 2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine

2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine (PubChem CID 165152302) has the molecular formula C58H37N and a molecular weight of 747.94 g/mol. Its IUPAC name is 2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine.

Molecular Properties

Compound Name2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine
PubChem CID165152302
Molecular FormulaC58H37N
Molecular Weight747.94 g/mol
Exact Mass747.29
IUPAC Name2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine
SMILESc1ccc(-c2cccc(-c3cc(-c4cccc(-c5cc6ccccc6c6c5-c5ccccc5C65c6ccccc6-c6ccccc65)c4)cc(-c4ccccc4)n3)c2)cc1
InChIInChI=1S/C58H37N/c1-3-17-38(18-4-1)40-22-16-25-44(34-40)55-37-45(36-54(59-55)39-19-5-2-6-20-39)41-23-15-24-42(33-41)50-35-43-21-7-8-26-46(43)57-56(50)49-29-11-14-32-53(49)58(57)51-30-12-9-27-47(51)48-28-10-13-31-52(48)58/h1-37H
InChIKeyRETZYDDLFMOIDR-UHFFFAOYSA-N
XLogP14.91
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms59
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500747.94
LogP ≤ 514.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

4-[3-[4-(11,11-diphenylbenzo[a]fluoren-6-yl)phenyl]phenyl]-2,6-diphenylpyridine
CID 165151992
4-(11,11-diphenylbenzo[a]fluoren-6-yl)-2,6-bis(3-phenylphenyl)pyridine
CID 165152143
4,6-bis(3-phenylphenyl)-2-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylpyrimidine
CID 165152179
4-[3-(11,11-dimethylbenzo[a]fluoren-6-yl)phenyl]-2,6-bis(3-phenylphenyl)pyridine
CID 165152303
4-(3,5-diphenylphenyl)-2-phenyl-6-spiro[fluorene-9,21'-pentacyclo[12.7.0.02,7.08,13.015,20]henicosa-1(14),2,4,6,8,10,12,15,17,19-decaene]-2-ylpyridine
CID 155186253
4-(11,11-dimethylbenzo[a]fluoren-6-yl)-2-(3,5-diphenylphenyl)-6-phenylpyridine
CID 165152041
2-(3,5-diphenylphenyl)-4-phenyl-6-(4-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)-1,3,5-triazine
CID 165152132
2-[4-(11,11-diphenylbenzo[a]fluoren-6-yl)phenyl]-4-(3,5-diphenylphenyl)-6-phenylpyrimidine
CID 165152292
2-phenyl-4-(3-phenylphenyl)-6-spiro[benzo[a]fluorene-11,9'-fluorene]-6-yl-1,3,5-triazine
CID 165151929
4-phenyl-2-(3-phenylphenyl)-6-(9,9'-spirobi[fluorene]-4'-yl)pyridine
CID 142356492
2-phenyl-6-[3-(3-phenylphenyl)phenyl]-4-(9,9'-spirobi[fluorene]-4'-yl)pyridine
CID 142356706
2,4-diphenyl-6-[3-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]phenyl]pyridine;2,4-diphenyl-6-[3-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]phenyl]pyridine;2,6-diphenyl-4-[3-[3-(9,9'-spirobi[fluorene]-2-yl)phenyl]phenyl]pyridine;2,6-diphenyl-4-[3-[4-(9,9'-spirobi[fluorene]-2-yl)phenyl]phenyl]pyridine
CID 161308623

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine?
The IUPAC name of 2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine (CID 165152302) is 2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine.
What is the SMILES notation for 2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine?
The canonical SMILES for 2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine is c1ccc(-c2cccc(-c3cc(-c4cccc(-c5cc6ccccc6c6c5-c5ccccc5C65c6ccccc6-c6ccccc65)c4)cc(-c4ccccc4)n3)c2)cc1.
What is the InChIKey of 2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine?
The InChIKey is RETZYDDLFMOIDR-UHFFFAOYSA-N. The full InChI is InChI=1S/C58H37N/c1-3-17-38(18-4-1)40-22-16-25-44(34-40)55-37-45(36-54(59-55)39-19-5-2-6-20-39)41-23-15-24-42(33-41)50-35-43-21-7-8-26-46(43)57-56(50)49-29-11-14-32-53(49)58(57)51-30-12-9-27-47(51)48-28-10-13-31-52(48)58/h1-37H.
What are the key properties of 2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine?
2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine has a molecular weight of 747.94 g/mol, XLogP of 14.91, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-6-(3-phenylphenyl)-4-(3-spiro[benzo[a]fluorene-11,9'-fluorene]-6-ylphenyl)pyridine is sourced from PubChem (CID 165152302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).