2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole

C121H106F2N14O5S — CID 164964765

IUPAC2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole
SMILESCc1cc(Oc2ccc(-c3ccc(F)cc3)nc2)ncc1CCc1cccnc1.Cc1ccccc1-c1ccc(Oc2ccc(CCc3cccnc3)c(C)n2)cc1C.Cc1nc(Oc2ccc(-c3ccc(F)cc3)nc2)ccc1CCc1cccnc1.Cc1nc(Oc2ccc(-c3ccccc3)nc2)ccc1CCc1cccnc1.Cc1nc(Oc2ccc(-c3nccs3)cc2)ccc1CCc1cccnc1
InChIInChI=1S/C27H26N2O.2C24H20FN3O.C24H21N3O.C22H19N3OS/c1-19-7-4-5-9-25(19)26-14-13-24(17-20(26)2)30-27-15-12-23(21(3)29-27)11-10-22-8-6-16-28-18-22;1-17-19(5-4-18-3-2-14-26-15-18)8-13-24(28-17)29-22-11-12-23(27-16-22)20-6-9-21(25)10-7-20;1-17-13-24(28-15-20(17)5-4-18-3-2-12-26-14-18)29-22-10-11-23(27-16-22)19-6-8-21(25)9-7-19;1-18-20(10-9-19-6-5-15-25-16-19)11-14-24(27-18)28-22-12-13-23(26-17-22)21-7-3-2-4-8-21;1-16-18(5-4-17-3-2-12-23-15-17)8-11-21(25-16)26-20-9-6-19(7-10-20)22-24-13-14-27-22/h4-9,12-18H,10-11H2,1-3H3;2*2-3,6-16H,4-5H2,1H3;2-8,11-17H,9-10H2,1H3;2-3,6-15H,4-5H2,1H3
InChIKeyCICMMFLTUYUJQA-UHFFFAOYSA-N
MW1906.33 g/mol
LogP28.68
Rot. Bonds30

About 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole

2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole (PubChem CID 164964765) has the molecular formula C121H106F2N14O5S and a molecular weight of 1906.33 g/mol. Its IUPAC name is 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole.

Molecular Properties

Compound Name2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole
PubChem CID164964765
Molecular FormulaC121H106F2N14O5S
Molecular Weight1906.33 g/mol
Exact Mass1904.82
IUPAC Name2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole
SMILESCc1cc(Oc2ccc(-c3ccc(F)cc3)nc2)ncc1CCc1cccnc1.Cc1ccccc1-c1ccc(Oc2ccc(CCc3cccnc3)c(C)n2)cc1C.Cc1nc(Oc2ccc(-c3ccc(F)cc3)nc2)ccc1CCc1cccnc1.Cc1nc(Oc2ccc(-c3ccccc3)nc2)ccc1CCc1cccnc1.Cc1nc(Oc2ccc(-c3nccs3)cc2)ccc1CCc1cccnc1
InChIInChI=1S/C27H26N2O.2C24H20FN3O.C24H21N3O.C22H19N3OS/c1-19-7-4-5-9-25(19)26-14-13-24(17-20(26)2)30-27-15-12-23(21(3)29-27)11-10-22-8-6-16-28-18-22;1-17-19(5-4-18-3-2-14-26-15-18)8-13-24(28-17)29-22-11-12-23(27-16-22)20-6-9-21(25)10-7-20;1-17-13-24(28-15-20(17)5-4-18-3-2-12-26-14-18)29-22-10-11-23(27-16-22)19-6-8-21(25)9-7-19;1-18-20(10-9-19-6-5-15-25-16-19)11-14-24(27-18)28-22-12-13-23(26-17-22)21-7-3-2-4-8-21;1-16-18(5-4-17-3-2-12-23-15-17)8-11-21(25-16)26-20-9-6-19(7-10-20)22-24-13-14-27-22/h4-9,12-18H,10-11H2,1-3H3;2*2-3,6-16H,4-5H2,1H3;2-8,11-17H,9-10H2,1H3;2-3,6-15H,4-5H2,1H3
InChIKeyCICMMFLTUYUJQA-UHFFFAOYSA-N
XLogP28.68
TPSA226.61 Ų
H-Bond Donors
H-Bond Acceptors20
Rotatable Bonds30
Heavy Atoms143
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5001906.33
LogP ≤ 528.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 1020

Analyze 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole?
The IUPAC name of 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole (CID 164964765) is 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole.
What is the SMILES notation for 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole?
The canonical SMILES for 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole is Cc1cc(Oc2ccc(-c3ccc(F)cc3)nc2)ncc1CCc1cccnc1.Cc1ccccc1-c1ccc(Oc2ccc(CCc3cccnc3)c(C)n2)cc1C.Cc1nc(Oc2ccc(-c3ccc(F)cc3)nc2)ccc1CCc1cccnc1.Cc1nc(Oc2ccc(-c3ccccc3)nc2)ccc1CCc1cccnc1.Cc1nc(Oc2ccc(-c3nccs3)cc2)ccc1CCc1cccnc1.
What is the InChIKey of 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole?
The InChIKey is CICMMFLTUYUJQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H26N2O.2C24H20FN3O.C24H21N3O.C22H19N3OS/c1-19-7-4-5-9-25(19)26-14-13-24(17-20(26)2)30-27-15-12-23(21(3)29-27)11-10-22-8-6-16-28-18-22;1-17-19(5-4-18-3-2-14-26-15-18)8-13-24(28-17)29-22-11-12-23(27-16-22)20-6-9-21(25)10-7-20;1-17-13-24(28-15-20(17)5-4-18-3-2-12-26-14-18)29-22-10-11-23(27-16-22)19-6-8-21(25)9-7-19;1-18-20(10-9-19-6-5-15-25-16-19)11-14-24(27-18)28-22-12-13-23(26-17-22)21-7-3-2-4-8-21;1-16-18(5-4-17-3-2-12-23-15-17)8-11-21(25-16)26-20-9-6-19(7-10-20)22-24-13-14-27-22/h4-9,12-18H,10-11H2,1-3H3;2*2-3,6-16H,4-5H2,1H3;2-8,11-17H,9-10H2,1H3;2-3,6-15H,4-5H2,1H3.
What are the key properties of 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole?
2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole has a molecular weight of 1906.33 g/mol, XLogP of 28.68, 30 rotatable bonds, 0 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[[6-(4-fluorophenyl)-3-pyridinyl]oxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[3-methyl-4-(2-methylphenyl)phenoxy]-3-(2-pyridin-3-ylethyl)pyridine;2-methyl-6-[(6-phenyl-3-pyridinyl)oxy]-3-(2-pyridin-3-ylethyl)pyridine;2-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole is sourced from PubChem (CID 164964765), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).