2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine

C77H58N4 — CID 58881210

IUPAC2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine
SMILESCC1(C)c2cc(-c3ccc4c(c3)C(C)(C)c3cc(-c5c(-c6ccccn6)cccc5-c5ccccn5)ccc3-4)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5c(-c6ccccn6)cccc5-c5ccccn5)ccc3-4)cc21
InChIInChI=1S/C77H58N4/c1-75(2)63-41-47(49-27-33-55-57-35-29-51(45-67(57)76(3,4)65(55)43-49)73-59(69-21-7-11-37-78-69)17-15-18-60(73)70-22-8-12-38-79-70)25-31-53(63)54-32-26-48(42-64(54)75)50-28-34-56-58-36-30-52(46-68(58)77(5,6)66(56)44-50)74-61(71-23-9-13-39-80-71)19-16-20-62(74)72-24-10-14-40-81-72/h7-46H,1-6H3
InChIKeyDAZLYPADCMTGLH-UHFFFAOYSA-N
MW1039.34 g/mol
LogP19.52
Rot. Bonds8

About 2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine

2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine (PubChem CID 58881210) has the molecular formula C77H58N4 and a molecular weight of 1039.34 g/mol. Its IUPAC name is 2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine.

Molecular Properties

Compound Name2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine
PubChem CID58881210
Molecular FormulaC77H58N4
Molecular Weight1039.34 g/mol
Exact Mass1038.47
IUPAC Name2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine
SMILESCC1(C)c2cc(-c3ccc4c(c3)C(C)(C)c3cc(-c5c(-c6ccccn6)cccc5-c5ccccn5)ccc3-4)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5c(-c6ccccn6)cccc5-c5ccccn5)ccc3-4)cc21
InChIInChI=1S/C77H58N4/c1-75(2)63-41-47(49-27-33-55-57-35-29-51(45-67(57)76(3,4)65(55)43-49)73-59(69-21-7-11-37-78-69)17-15-18-60(73)70-22-8-12-38-79-70)25-31-53(63)54-32-26-48(42-64(54)75)50-28-34-56-58-36-30-52(46-68(58)77(5,6)66(56)44-50)74-61(71-23-9-13-39-80-71)19-16-20-62(74)72-24-10-14-40-81-72/h7-46H,1-6H3
InChIKeyDAZLYPADCMTGLH-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-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine?
The IUPAC name of 2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine (CID 58881210) is 2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine.
What is the SMILES notation for 2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine?
The canonical SMILES for 2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine is CC1(C)c2cc(-c3ccc4c(c3)C(C)(C)c3cc(-c5c(-c6ccccn6)cccc5-c5ccccn5)ccc3-4)ccc2-c2ccc(-c3ccc4c(c3)C(C)(C)c3cc(-c5c(-c6ccccn6)cccc5-c5ccccn5)ccc3-4)cc21.
What is the InChIKey of 2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine?
The InChIKey is DAZLYPADCMTGLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C77H58N4/c1-75(2)63-41-47(49-27-33-55-57-35-29-51(45-67(57)76(3,4)65(55)43-49)73-59(69-21-7-11-37-78-69)17-15-18-60(73)70-22-8-12-38-79-70)25-31-53(63)54-32-26-48(42-64(54)75)50-28-34-56-58-36-30-52(46-68(58)77(5,6)66(56)44-50)74-61(71-23-9-13-39-80-71)19-16-20-62(74)72-24-10-14-40-81-72/h7-46H,1-6H3.
What are the key properties of 2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine?
2-[2-[7-[7-[7-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-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-(2,6-dipyridin-2-ylphenyl)-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-9,9-dimethylfluoren-2-yl]-3-pyridin-2-ylphenyl]pyridine is sourced from PubChem (CID 58881210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).