2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine

C134H106F6N6 — CID 90857221

IUPAC2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine
SMILESCc1cc(-c2cccc(-c3cc(-c4ccccc4C)c(-c4cccc(-c5cc(C)cc(C(F)(F)F)c5)n4)cc3-c3ccccc3C)n2)cc(C(F)(F)F)c1.Cc1ccccc1-c1cc(-c2cccc(-c3c(C)cccc3C)n2)c(-c2ccccc2C)cc1-c1cccc(-c2c(C)cccc2C)n1.Cc1ccccc1-c1cc(-c2cccc(-c3ccccc3)n2)c(-c2ccccc2C)cc1-c1cccc(-c2ccccc2)n1
InChIInChI=1S/C46H34F6N2.C46H40N2.C42H32N2/c1-27-19-31(23-33(21-27)45(47,48)49)41-15-9-17-43(53-41)39-25-38(36-14-8-6-12-30(36)4)40(26-37(39)35-13-7-5-11-29(35)3)44-18-10-16-42(54-44)32-20-28(2)22-34(24-32)46(50,51)52;1-29-15-7-9-21-35(29)37-27-40(42-24-14-26-44(48-42)46-33(5)19-12-20-34(46)6)38(36-22-10-8-16-30(36)2)28-39(37)41-23-13-25-43(47-41)45-31(3)17-11-18-32(45)4;1-29-15-9-11-21-33(29)35-27-38(42-26-14-24-40(44-42)32-19-7-4-8-20-32)36(34-22-12-10-16-30(34)2)28-37(35)41-25-13-23-39(43-41)31-17-5-3-6-18-31/h5-26H,1-4H3;7-28H,1-6H3;3-28H,1-2H3
InChIKeyZOFBXFKYLWWTNQ-UHFFFAOYSA-N
MW1914.35 g/mol
LogP37.17
Rot. Bonds18

About 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine

2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine (PubChem CID 90857221) has the molecular formula C134H106F6N6 and a molecular weight of 1914.35 g/mol. Its IUPAC name is 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine.

Molecular Properties

Compound Name2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine
PubChem CID90857221
Molecular FormulaC134H106F6N6
Molecular Weight1914.35 g/mol
Exact Mass1912.84
IUPAC Name2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine
SMILESCc1cc(-c2cccc(-c3cc(-c4ccccc4C)c(-c4cccc(-c5cc(C)cc(C(F)(F)F)c5)n4)cc3-c3ccccc3C)n2)cc(C(F)(F)F)c1.Cc1ccccc1-c1cc(-c2cccc(-c3c(C)cccc3C)n2)c(-c2ccccc2C)cc1-c1cccc(-c2c(C)cccc2C)n1.Cc1ccccc1-c1cc(-c2cccc(-c3ccccc3)n2)c(-c2ccccc2C)cc1-c1cccc(-c2ccccc2)n1
InChIInChI=1S/C46H34F6N2.C46H40N2.C42H32N2/c1-27-19-31(23-33(21-27)45(47,48)49)41-15-9-17-43(53-41)39-25-38(36-14-8-6-12-30(36)4)40(26-37(39)35-13-7-5-11-29(35)3)44-18-10-16-42(54-44)32-20-28(2)22-34(24-32)46(50,51)52;1-29-15-7-9-21-35(29)37-27-40(42-24-14-26-44(48-42)46-33(5)19-12-20-34(46)6)38(36-22-10-8-16-30(36)2)28-39(37)41-23-13-25-43(47-41)45-31(3)17-11-18-32(45)4;1-29-15-9-11-21-33(29)35-27-38(42-26-14-24-40(44-42)32-19-7-4-8-20-32)36(34-22-12-10-16-30(34)2)28-37(35)41-25-13-23-39(43-41)31-17-5-3-6-18-31/h5-26H,1-4H3;7-28H,1-6H3;3-28H,1-2H3
InChIKeyZOFBXFKYLWWTNQ-UHFFFAOYSA-N
XLogP37.17
TPSA77.34 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds18
Heavy Atoms146
Complexity

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 5001914.35
LogP ≤ 537.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine?
The IUPAC name of 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine (CID 90857221) is 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine.
What is the SMILES notation for 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine?
The canonical SMILES for 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine is Cc1cc(-c2cccc(-c3cc(-c4ccccc4C)c(-c4cccc(-c5cc(C)cc(C(F)(F)F)c5)n4)cc3-c3ccccc3C)n2)cc(C(F)(F)F)c1.Cc1ccccc1-c1cc(-c2cccc(-c3c(C)cccc3C)n2)c(-c2ccccc2C)cc1-c1cccc(-c2c(C)cccc2C)n1.Cc1ccccc1-c1cc(-c2cccc(-c3ccccc3)n2)c(-c2ccccc2C)cc1-c1cccc(-c2ccccc2)n1.
What is the InChIKey of 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine?
The InChIKey is ZOFBXFKYLWWTNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C46H34F6N2.C46H40N2.C42H32N2/c1-27-19-31(23-33(21-27)45(47,48)49)41-15-9-17-43(53-41)39-25-38(36-14-8-6-12-30(36)4)40(26-37(39)35-13-7-5-11-29(35)3)44-18-10-16-42(54-44)32-20-28(2)22-34(24-32)46(50,51)52;1-29-15-7-9-21-35(29)37-27-40(42-24-14-26-44(48-42)46-33(5)19-12-20-34(46)6)38(36-22-10-8-16-30(36)2)28-39(37)41-23-13-25-43(47-41)45-31(3)17-11-18-32(45)4;1-29-15-9-11-21-33(29)35-27-38(42-26-14-24-40(44-42)32-19-7-4-8-20-32)36(34-22-12-10-16-30(34)2)28-37(35)41-25-13-23-39(43-41)31-17-5-3-6-18-31/h5-26H,1-4H3;7-28H,1-6H3;3-28H,1-2H3.
What are the key properties of 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine?
2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine has a molecular weight of 1914.35 g/mol, XLogP of 37.17, 18 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2,5-bis(2-methylphenyl)-4-[6-[3-methyl-5-(trifluoromethyl)phenyl]-2-pyridinyl]phenyl]-6-[3-methyl-5-(trifluoromethyl)phenyl]pyridine;2-[2,5-bis(2-methylphenyl)-4-(6-phenyl-2-pyridinyl)phenyl]-6-phenylpyridine;2-(2,6-dimethylphenyl)-6-[4-[6-(2,6-dimethylphenyl)-2-pyridinyl]-2,5-bis(2-methylphenyl)phenyl]pyridine is sourced from PubChem (CID 90857221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).