2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine

C130H88F4N6 — CID 134434276

IUPAC2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine
SMILESCc1cc(-c2ccc(-c3ccccc3-c3cc(-c4ccccc4-c4ccc(-c5cc(C)c(-c6ccc(F)cc6)cn5)cc4)cc(-c4ccccc4-c4ccc(-c5ccc(-c6ccccc6-c6cc(-c7ccccc7-c7ccc(-c8cc(C)c(-c9ccc(F)cc9)cn8)cc7)cc(-c7ccccc7-c7ccc(-c8cc(C)c(-c9ccc(F)cc9)cn8)cc7)c6)cn5)nc4)c3)cc2)ncc1-c1ccc(F)cc1
InChIInChI=1S/C130H88F4N6/c1-81-65-127(137-77-121(81)89-45-55-105(131)56-46-89)93-37-29-85(30-38-93)109-17-5-11-23-115(109)99-69-100(116-24-12-6-18-110(116)86-31-39-94(40-32-86)128-66-82(2)122(78-138-128)90-47-57-106(132)58-48-90)72-103(71-99)119-27-15-9-21-113(119)97-53-63-125(135-75-97)126-64-54-98(76-136-126)114-22-10-16-28-120(114)104-73-101(117-25-13-7-19-111(117)87-33-41-95(42-34-87)129-67-83(3)123(79-139-129)91-49-59-107(133)60-50-91)70-102(74-104)118-26-14-8-20-112(118)88-35-43-96(44-36-88)130-68-84(4)124(80-140-130)92-51-61-108(134)62-52-92/h5-80H,1-4H3
InChIKeyBISMKUHMBZSZSL-UHFFFAOYSA-N
MW1810.17 g/mol
LogP34.85
Rot. Bonds21

About 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine

2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine (PubChem CID 134434276) has the molecular formula C130H88F4N6 and a molecular weight of 1810.17 g/mol. Its IUPAC name is 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine.

Molecular Properties

Compound Name2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine
PubChem CID134434276
Molecular FormulaC130H88F4N6
Molecular Weight1810.17 g/mol
Exact Mass1808.70
IUPAC Name2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine
SMILESCc1cc(-c2ccc(-c3ccccc3-c3cc(-c4ccccc4-c4ccc(-c5cc(C)c(-c6ccc(F)cc6)cn5)cc4)cc(-c4ccccc4-c4ccc(-c5ccc(-c6ccccc6-c6cc(-c7ccccc7-c7ccc(-c8cc(C)c(-c9ccc(F)cc9)cn8)cc7)cc(-c7ccccc7-c7ccc(-c8cc(C)c(-c9ccc(F)cc9)cn8)cc7)c6)cn5)nc4)c3)cc2)ncc1-c1ccc(F)cc1
InChIInChI=1S/C130H88F4N6/c1-81-65-127(137-77-121(81)89-45-55-105(131)56-46-89)93-37-29-85(30-38-93)109-17-5-11-23-115(109)99-69-100(116-24-12-6-18-110(116)86-31-39-94(40-32-86)128-66-82(2)122(78-138-128)90-47-57-106(132)58-48-90)72-103(71-99)119-27-15-9-21-113(119)97-53-63-125(135-75-97)126-64-54-98(76-136-126)114-22-10-16-28-120(114)104-73-101(117-25-13-7-19-111(117)87-33-41-95(42-34-87)129-67-83(3)123(79-139-129)91-49-59-107(133)60-50-91)70-102(74-104)118-26-14-8-20-112(118)88-35-43-96(44-36-88)130-68-84(4)124(80-140-130)92-51-61-108(134)62-52-92/h5-80H,1-4H3
InChIKeyBISMKUHMBZSZSL-UHFFFAOYSA-N
XLogP34.85
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds21
Heavy Atoms140
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001810.17
LogP ≤ 534.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine?
The IUPAC name of 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine (CID 134434276) is 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine.
What is the SMILES notation for 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine?
The canonical SMILES for 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine is Cc1cc(-c2ccc(-c3ccccc3-c3cc(-c4ccccc4-c4ccc(-c5cc(C)c(-c6ccc(F)cc6)cn5)cc4)cc(-c4ccccc4-c4ccc(-c5ccc(-c6ccccc6-c6cc(-c7ccccc7-c7ccc(-c8cc(C)c(-c9ccc(F)cc9)cn8)cc7)cc(-c7ccccc7-c7ccc(-c8cc(C)c(-c9ccc(F)cc9)cn8)cc7)c6)cn5)nc4)c3)cc2)ncc1-c1ccc(F)cc1.
What is the InChIKey of 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine?
The InChIKey is BISMKUHMBZSZSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C130H88F4N6/c1-81-65-127(137-77-121(81)89-45-55-105(131)56-46-89)93-37-29-85(30-38-93)109-17-5-11-23-115(109)99-69-100(116-24-12-6-18-110(116)86-31-39-94(40-32-86)128-66-82(2)122(78-138-128)90-47-57-106(132)58-48-90)72-103(71-99)119-27-15-9-21-113(119)97-53-63-125(135-75-97)126-64-54-98(76-136-126)114-22-10-16-28-120(114)104-73-101(117-25-13-7-19-111(117)87-33-41-95(42-34-87)129-67-83(3)123(79-139-129)91-49-59-107(133)60-50-91)70-102(74-104)118-26-14-8-20-112(118)88-35-43-96(44-36-88)130-68-84(4)124(80-140-130)92-51-61-108(134)62-52-92/h5-80H,1-4H3.
What are the key properties of 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine?
2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine has a molecular weight of 1810.17 g/mol, XLogP of 34.85, 21 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[2-[3-[2-[6-[5-[2-[3,5-bis[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]-2-pyridinyl]-3-pyridinyl]phenyl]-5-[2-[4-[5-(4-fluorophenyl)-4-methyl-2-pyridinyl]phenyl]phenyl]phenyl]phenyl]phenyl]-5-(4-fluorophenyl)-4-methylpyridine is sourced from PubChem (CID 134434276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).