9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane

C62H48N2 — CID 162124636

IUPAC9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane
SMILESC.C.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cccc(-c5cc(-n6c7ccccc7c7ccccc76)ccc5C5c6ccccc6-c6ccccc65)c4)c3)cc2)cc1
InChIInChI=1S/C60H40N2.2CH4/c1-3-16-40(17-4-1)41-30-32-42(33-31-41)46-37-56(43-18-5-2-6-19-43)61-57(38-46)45-21-15-20-44(36-45)55-39-47(62-58-28-13-11-24-50(58)51-25-12-14-29-59(51)62)34-35-54(55)60-52-26-9-7-22-48(52)49-23-8-10-27-53(49)60;;/h1-39,60H;2*1H4
InChIKeyZHWBLEUZXFANKQ-UHFFFAOYSA-N
MW821.08 g/mol
LogP16.95
Rot. Bonds7

About 9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane

9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane (PubChem CID 162124636) has the molecular formula C62H48N2 and a molecular weight of 821.08 g/mol. Its IUPAC name is 9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane.

Molecular Properties

Compound Name9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane
PubChem CID162124636
Molecular FormulaC62H48N2
Molecular Weight821.08 g/mol
Exact Mass820.38
IUPAC Name9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane
SMILESC.C.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cccc(-c5cc(-n6c7ccccc7c7ccccc76)ccc5C5c6ccccc6-c6ccccc65)c4)c3)cc2)cc1
InChIInChI=1S/C60H40N2.2CH4/c1-3-16-40(17-4-1)41-30-32-42(33-31-41)46-37-56(43-18-5-2-6-19-43)61-57(38-46)45-21-15-20-44(36-45)55-39-47(62-58-28-13-11-24-50(58)51-25-12-14-29-59(51)62)34-35-54(55)60-52-26-9-7-22-48(52)49-23-8-10-27-53(49)60;;/h1-39,60H;2*1H4
InChIKeyZHWBLEUZXFANKQ-UHFFFAOYSA-N
XLogP16.95
TPSA17.82 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms64
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500821.08
LogP ≤ 516.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

9-[3-[4-(4-carbazol-9-ylphenyl)-6-[3-(9H-fluoren-9-yl)phenyl]-2-pyridinyl]phenyl]carbazole;9-[3-[6-(3-carbazol-9-ylphenyl)-4-(4-phenylphenyl)-2-pyridinyl]phenyl]carbazole;9-[3-[3-[6-[3-(3-carbazol-9-ylphenyl)phenyl]-4-phenyl-2-pyridinyl]phenyl]phenyl]carbazole;9-[4-[3-[6-[3-(4-carbazol-9-ylphenyl)phenyl]-4-phenyl-2-pyridinyl]phenyl]phenyl]carbazole
CID 161277059
9-[3-[4-[6-[4-(3-carbazol-9-ylphenyl)phenyl]-4-phenyl-2-pyridinyl]phenyl]phenyl]carbazole;methane
CID 157279504
9-[4-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]phenyl]phenyl]carbazole
CID 58943390
9-[4-[3-[3-[3-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]phenyl]phenyl]carbazole
CID 58943594
9-[4-[4-[3-[3-[3-[2,6-bis(4-carbazol-9-ylphenyl)-4-pyridinyl]phenyl]-5-phenylphenyl]phenyl]-6-(4-carbazol-9-ylphenyl)-2-pyridinyl]phenyl]carbazole
CID 58943378
9-[4-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-5-phenylphenyl]phenyl]carbazole
CID 58943692
9-[4-[3-[6-[3-[4-(4,6-diphenyl-2-pyridinyl)phenyl]phenyl]-2-pyridinyl]phenyl]phenyl]carbazole
CID 58943592
9-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]phenyl]carbazole
CID 58943621
9-[3-[4-[4-(2,6-diphenyl-4-pyridinyl)phenyl]phenyl]-5-phenylphenyl]carbazole
CID 58943750
9-[4-[4-[3-[3-[4-[2,6-bis(4-carbazol-9-ylphenyl)-4-pyridinyl]phenyl]phenyl]phenyl]-6-(4-carbazol-9-ylphenyl)-2-pyridinyl]phenyl]carbazole;9-[4-[4-[3-[4-[4-[2,6-bis(4-carbazol-9-ylphenyl)-4-pyridinyl]phenyl]phenyl]phenyl]-6-(4-carbazol-9-ylphenyl)-2-pyridinyl]phenyl]carbazole
CID 157372045
7-[4-(4,6-diphenyl-2-pyridinyl)phenyl]-5-phenyl-7H-indeno[2,1-b]carbazole
CID 126753657
9-[3-carbazol-9-yl-5-[6-[4-[3-(4-carbazol-9-ylphenyl)phenyl]phenyl]-4-phenyl-2-pyridinyl]phenyl]carbazole
CID 58527010

Frequently Asked Questions

What is the IUPAC name of 9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane?
The IUPAC name of 9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane (CID 162124636) is 9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane.
What is the SMILES notation for 9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane?
The canonical SMILES for 9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane is C.C.c1ccc(-c2ccc(-c3cc(-c4ccccc4)nc(-c4cccc(-c5cc(-n6c7ccccc7c7ccccc76)ccc5C5c6ccccc6-c6ccccc65)c4)c3)cc2)cc1.
What is the InChIKey of 9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane?
The InChIKey is ZHWBLEUZXFANKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C60H40N2.2CH4/c1-3-16-40(17-4-1)41-30-32-42(33-31-41)46-37-56(43-18-5-2-6-19-43)61-57(38-46)45-21-15-20-44(36-45)55-39-47(62-58-28-13-11-24-50(58)51-25-12-14-29-59(51)62)34-35-54(55)60-52-26-9-7-22-48(52)49-23-8-10-27-53(49)60;;/h1-39,60H;2*1H4.
What are the key properties of 9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane?
9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane has a molecular weight of 821.08 g/mol, XLogP of 16.95, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[4-(9H-fluoren-9-yl)-3-[3-[6-phenyl-4-(4-phenylphenyl)-2-pyridinyl]phenyl]phenyl]carbazole;methane is sourced from PubChem (CID 162124636), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).