2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine

C77H58N4 — CID 58881237

IUPAC2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine
SMILESCC1(C)c2cc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6ccccn6)ccc5-c5ccccn5)ccc3-4)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6ccccn6)ccc5-c5ccccn5)ccc3-4)cc21
InChIInChI=1S/C77H58N4/c1-75(2)65-41-47(49-21-29-57-59-31-23-51(45-69(59)76(3,4)67(57)43-49)63-39-53(71-15-7-11-35-78-71)25-33-61(63)73-17-9-13-37-80-73)19-27-55(65)56-28-20-48(42-66(56)75)50-22-30-58-60-32-24-52(46-70(60)77(5,6)68(58)44-50)64-40-54(72-16-8-12-36-79-72)26-34-62(64)74-18-10-14-38-81-74/h7-46H,1-6H3
InChIKeyQIFDRPDZFLBBIQ-UHFFFAOYSA-N
MW1039.34 g/mol
LogP19.52
Rot. Bonds8

About 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine

2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine (PubChem CID 58881237) has the molecular formula C77H58N4 and a molecular weight of 1039.34 g/mol. Its IUPAC name is 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine.

Molecular Properties

Compound Name2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine
PubChem CID58881237
Molecular FormulaC77H58N4
Molecular Weight1039.34 g/mol
Exact Mass1038.47
IUPAC Name2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine
SMILESCC1(C)c2cc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6ccccn6)ccc5-c5ccccn5)ccc3-4)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6ccccn6)ccc5-c5ccccn5)ccc3-4)cc21
InChIInChI=1S/C77H58N4/c1-75(2)65-41-47(49-21-29-57-59-31-23-51(45-69(59)76(3,4)67(57)43-49)63-39-53(71-15-7-11-35-78-71)25-33-61(63)73-17-9-13-37-80-73)19-27-55(65)56-28-20-48(42-66(56)75)50-22-30-58-60-32-24-52(46-70(60)77(5,6)68(58)44-50)64-40-54(72-16-8-12-36-79-72)26-34-62(64)74-18-10-14-38-81-74/h7-46H,1-6H3
InChIKeyQIFDRPDZFLBBIQ-UHFFFAOYSA-N
XLogP19.52
TPSA51.56 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms81
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001039.34
LogP ≤ 519.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine?
The IUPAC name of 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine (CID 58881237) is 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine.
What is the SMILES notation for 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine?
The canonical SMILES for 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine is CC1(C)c2cc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6ccccn6)ccc5-c5ccccn5)ccc3-4)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5cc(-c6ccccn6)ccc5-c5ccccn5)ccc3-4)cc21.
What is the InChIKey of 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine?
The InChIKey is QIFDRPDZFLBBIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C77H58N4/c1-75(2)65-41-47(49-21-29-57-59-31-23-51(45-69(59)76(3,4)67(57)43-49)63-39-53(71-15-7-11-35-78-71)25-33-61(63)73-17-9-13-37-80-73)19-27-55(65)56-28-20-48(42-66(56)75)50-22-30-58-60-32-24-52(46-70(60)77(5,6)68(58)44-50)64-40-54(72-16-8-12-36-79-72)26-34-62(64)74-18-10-14-38-81-74/h7-46H,1-6H3.
What are the key properties of 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine?
2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine has a molecular weight of 1039.34 g/mol, XLogP of 19.52, 8 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-[7-[7-[7-(2,5-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-4-pyridin-2-ylphenyl]pyridine is sourced from PubChem (CID 58881237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).