2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine

C74H48N2O — CID 140743379

IUPAC2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine
SMILESc1ccc(C2(c3ccccn3)c3ccccc3C3(c4ccccc4-c4ccccc43)c3cc(Oc4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4C5(c4ccccc4)c4ccccn4)ccc32)cc1
InChIInChI=1S/C74H48N2O/c1-3-23-49(24-4-1)71(69-39-19-21-45-75-69)61-35-15-17-37-63(61)73(57-31-11-7-27-53(57)54-28-8-12-32-58(54)73)67-47-51(41-43-65(67)71)77-52-42-44-66-68(48-52)74(59-33-13-9-29-55(59)56-30-10-14-34-60(56)74)64-38-18-16-36-62(64)72(66,50-25-5-2-6-26-50)70-40-20-22-46-76-70/h1-48H
InChIKeyPVJHWORRVLYHIQ-UHFFFAOYSA-N
MW981.21 g/mol
LogP16.39
Rot. Bonds6

About 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine

2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine (PubChem CID 140743379) has the molecular formula C74H48N2O and a molecular weight of 981.21 g/mol. Its IUPAC name is 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine.

Molecular Properties

Compound Name2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine
PubChem CID140743379
Molecular FormulaC74H48N2O
Molecular Weight981.21 g/mol
Exact Mass980.38
IUPAC Name2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine
SMILESc1ccc(C2(c3ccccn3)c3ccccc3C3(c4ccccc4-c4ccccc43)c3cc(Oc4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4C5(c4ccccc4)c4ccccn4)ccc32)cc1
InChIInChI=1S/C74H48N2O/c1-3-23-49(24-4-1)71(69-39-19-21-45-75-69)61-35-15-17-37-63(61)73(57-31-11-7-27-53(57)54-28-8-12-32-58(54)73)67-47-51(41-43-65(67)71)77-52-42-44-66-68(48-52)74(59-33-13-9-29-55(59)56-30-10-14-34-60(56)74)64-38-18-16-36-62(64)72(66,50-25-5-2-6-26-50)70-40-20-22-46-76-70/h1-48H
InChIKeyPVJHWORRVLYHIQ-UHFFFAOYSA-N
XLogP16.39
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms77
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500981.21
LogP ≤ 516.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine with MolForge

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Related Compounds

4-methyl-2-[3-[3-(9-pyridin-2-ylfluoren-9-yl)phenoxy]phenyl]pyridine
CID 158341283
2,4-diphenyl-6-(9-phenyl-9-pyridin-2-ylfluoren-3-yl)pyrimidine
CID 142384952
2-[9-[3-[3-(3,5-dimethylpyrazol-1-yl)phenoxy]phenyl]fluoren-9-yl]pyridine
CID 140716419
11-phenyl-11-pyridin-2-yl-5H-indeno[1,2-b]carbazole
CID 135176930
2-[4-[3-(9,9-diphenylfluoren-2-yl)phenyl]-9-phenylfluoren-9-yl]pyridine
CID 135173134
2-(9-phenylfluoren-9-yl)pyrazine
CID 177449195
4-(9-phenylfluoren-9-yl)pyrimidine
CID 174340696
bis(4-hydroxypent-3-en-2-one);platinum;platinum(2+);2-[9-[3-[3-(9-pyridin-2-ylfluoren-9-yl)benzene-2-id-1-yl]oxybenzene-2-id-1-yl]fluoren-9-yl]pyridine;2-[9-[3-[3-(9-pyridin-2-ylfluoren-9-yl)phenoxy]phenyl]fluoren-9-yl]pyridine
CID 158459464
2-[(9-phenyl-9-pyridin-2-ylfluoren-2-yl)methylsulfanyl]aniline
CID 145384387
4-tert-butyl-2-[5-[3-(9-pyridin-2-ylfluoren-9-yl)phenoxy]furan-3-yl]pyridine
CID 157130498
2-bromo-10,10-diphenylspiro[anthracene-9,9'-fluorene]
CID 142567718
2-[9-[3-[4-(3-methyl-2H-imidazol-1-yl)thiophen-2-yl]oxyphenyl]fluoren-9-yl]pyridine
CID 159415024

Frequently Asked Questions

What is the IUPAC name of 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine?
The IUPAC name of 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine (CID 140743379) is 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine.
What is the SMILES notation for 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine?
The canonical SMILES for 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine is c1ccc(C2(c3ccccn3)c3ccccc3C3(c4ccccc4-c4ccccc43)c3cc(Oc4ccc5c(c4)C4(c6ccccc6-c6ccccc64)c4ccccc4C5(c4ccccc4)c4ccccn4)ccc32)cc1.
What is the InChIKey of 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine?
The InChIKey is PVJHWORRVLYHIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C74H48N2O/c1-3-23-49(24-4-1)71(69-39-19-21-45-75-69)61-35-15-17-37-63(61)73(57-31-11-7-27-53(57)54-28-8-12-32-58(54)73)67-47-51(41-43-65(67)71)77-52-42-44-66-68(48-52)74(59-33-13-9-29-55(59)56-30-10-14-34-60(56)74)64-38-18-16-36-62(64)72(66,50-25-5-2-6-26-50)70-40-20-22-46-76-70/h1-48H.
What are the key properties of 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine?
2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine has a molecular weight of 981.21 g/mol, XLogP of 16.39, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[9-phenyl-3-(10-phenyl-10-pyridin-2-ylspiro[anthracene-9,9'-fluorene]-2-yl)oxyspiro[anthracene-10,9'-fluorene]-9-yl]pyridine is sourced from PubChem (CID 140743379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).