5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine

C165H111N3 — CID 153429712

About 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine

5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine (PubChem CID 153429712) has the molecular formula C165H111N3 and a molecular weight of 2135.72 g/mol. Its IUPAC name is 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine.

Molecular Properties

• Compound Name: 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine
• PubChem CID: 153429712
• Molecular Formula: C165H111N3
• Molecular Weight: 2135.72 g/mol
• Exact Mass: 2133.88
• IUPAC Name: 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine
• SMILES: c1ccc(-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3cccc(-c4ccc(-c5ccccc5-c5cc(-c6ccccc6-c6ccc(-c7cccc(-c8c(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)c7)nc6)cc(-c6ccccc6-c6ccc(-c7cccc(-c8c(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)c7)nc6)c5)cn4)c3)c(-c3ccccc3)c2-c2ccccc2)cc1
• InChI: InChI=1S/C165H111N3/c1-16-55-112(56-17-1)148-151(115-61-22-4-23-62-115)157(121-73-34-10-35-74-121)163(158(122-75-36-11-37-76-122)152(148)116-63-24-5-25-64-116)130-88-52-85-127(103-130)145-100-97-133(109-166-145)139-91-46-49-94-142(139)136-106-137(143-95-50-47-92-140(143)134-98-101-146(167-110-134)128-86-53-89-131(104-128)164-159(123-77-38-12-39-78-123)153(117-65-26-6-27-66-117)149(113-57-18-2-19-58-113)154(118-67-28-7-29-68-118)160(164)124-79-40-13-41-80-124)108-138(107-136)144-96-51-48-93-141(144)135-99-102-147(168-111-135)129-87-54-90-132(105-129)165-161(125-81-42-14-43-82-125)155(119-69-30-8-31-70-119)150(114-59-20-3-21-60-114)156(120-71-32-9-33-72-120)162(165)126-83-44-15-45-84-126/h1-111H
• InChIKey: NZTYMUVTNLFYSE-UHFFFAOYSA-N
• XLogP: 44.88
• TPSA: 38.67 Ų
• H-Bond Acceptors: 3
• Rotatable Bonds: 27
• Heavy Atoms: 168
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	2135.72
LogP ≤ 5	44.88
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	3

Frequently Asked Questions

What is the IUPAC name of 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine?

The IUPAC name of 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine (CID 153429712) is 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine.

What is the SMILES notation for 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine?

The canonical SMILES for 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine is c1ccc(-c2c(-c3ccccc3)c(-c3ccccc3)c(-c3cccc(-c4ccc(-c5ccccc5-c5cc(-c6ccccc6-c6ccc(-c7cccc(-c8c(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)c7)nc6)cc(-c6ccccc6-c6ccc(-c7cccc(-c8c(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c(-c9ccccc9)c8-c8ccccc8)c7)nc6)c5)cn4)c3)c(-c3ccccc3)c2-c2ccccc2)cc1.

What is the InChIKey of 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine?

The InChIKey is NZTYMUVTNLFYSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C165H111N3/c1-16-55-112(56-17-1)148-151(115-61-22-4-23-62-115)157(121-73-34-10-35-74-121)163(158(122-75-36-11-37-76-122)152(148)116-63-24-5-25-64-116)130-88-52-85-127(103-130)145-100-97-133(109-166-145)139-91-46-49-94-142(139)136-106-137(143-95-50-47-92-140(143)134-98-101-146(167-110-134)128-86-53-89-131(104-128)164-159(123-77-38-12-39-78-123)153(117-65-26-6-27-66-117)149(113-57-18-2-19-58-113)154(118-67-28-7-29-68-118)160(164)124-79-40-13-41-80-124)108-138(107-136)144-96-51-48-93-141(144)135-99-102-147(168-111-135)129-87-54-90-132(105-129)165-161(125-81-42-14-43-82-125)155(119-69-30-8-31-70-119)150(114-59-20-3-21-60-114)156(120-71-32-9-33-72-120)162(165)126-83-44-15-45-84-126/h1-111H.

What are the key properties of 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine?

5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine has a molecular weight of 2135.72 g/mol, XLogP of 44.88, 27 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.

Where does this data come from?

All data for 5-[2-[3,5-bis[2-[6-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]-3-pyridinyl]phenyl]phenyl]phenyl]-2-[3-(2,3,4,5,6-pentakis-phenylphenyl)phenyl]pyridine is sourced from PubChem (CID 153429712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).