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

C171H151F4N13O7S2 — CID 165067698

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

3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole (PubChem CID 165067698) has the molecular formula C171H151F4N13O7S2 and a molecular weight of 2640.30 g/mol. Its IUPAC name is 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole.

Molecular Properties

• Compound Name: 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole
• PubChem CID: 165067698
• Molecular Formula: C171H151F4N13O7S2
• Molecular Weight: 2640.30 g/mol
• Exact Mass: 2638.12
• IUPAC Name: 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole
• SMILES: Cc1cc(Oc2ccc(-c3ccc(F)cc3)cc2)ncc1CCc1cccnc1.Cc1cc(Oc2ccc(-c3cncs3)cc2)ncc1CCc1cccnc1.Cc1ccccc1-c1ccc(Oc2ccc(CCc3cccnc3)cc2)cc1C.Cc1nc(Oc2ccc(-c3ccc(F)cc3)cc2)ccc1CCc1cccnc1.Cc1nc(Oc2ccc(-c3cncs3)cc2)ccc1CCc1cccnc1.Fc1cc(CCc2cccnc2)ccc1Oc1ccc(C2CCCCC2)cc1.Fc1ccc(-c2ccc(Oc3ccc(CCc4cccnc4)cc3)cc2)cc1
• InChI: InChI=1S/C27H25NO.2C25H21FN2O.C25H20FNO.C25H26FNO.2C22H19N3OS/c1-20-6-3-4-8-26(20)27-16-15-25(18-21(27)2)29-24-13-11-22(12-14-24)9-10-23-7-5-17-28-19-23;1-18-20(5-4-19-3-2-16-27-17-19)10-15-25(28-18)29-24-13-8-22(9-14-24)21-6-11-23(26)12-7-21;1-18-15-25(28-17-22(18)5-4-19-3-2-14-27-16-19)29-24-12-8-21(9-13-24)20-6-10-23(26)11-7-20;26-23-11-7-21(8-12-23)22-9-15-25(16-10-22)28-24-13-5-19(6-14-24)3-4-20-2-1-17-27-18-20;26-24-17-19(8-9-20-5-4-16-27-18-20)10-15-25(24)28-23-13-11-22(12-14-23)21-6-2-1-3-7-21;1-16-18(5-4-17-3-2-12-23-13-17)8-11-22(25-16)26-20-9-6-19(7-10-20)21-14-24-15-27-21;1-16-11-22(25-13-19(16)5-4-17-3-2-10-23-12-17)26-20-8-6-18(7-9-20)21-14-24-15-27-21/h3-8,11-19H,9-10H2,1-2H3;2*2-3,6-17H,4-5H2,1H3;1-2,5-18H,3-4H2;4-5,10-18,21H,1-3,6-9H2;2*2-3,6-15H,4-5H2,1H3
• InChIKey: SFYNCTSEPMPEJB-UHFFFAOYSA-N
• XLogP: 43.56
• TPSA: 232.18 Ų
• H-Bond Acceptors: 22
• Rotatable Bonds: 42
• Heavy Atoms: 197
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2640.30
LogP ≤ 5	43.56
H-Bond Donors ≤ 5	0
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole?

The IUPAC name of 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole (CID 165067698) is 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole.

What is the SMILES notation for 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole?

The canonical SMILES for 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole is Cc1cc(Oc2ccc(-c3ccc(F)cc3)cc2)ncc1CCc1cccnc1.Cc1cc(Oc2ccc(-c3cncs3)cc2)ncc1CCc1cccnc1.Cc1ccccc1-c1ccc(Oc2ccc(CCc3cccnc3)cc2)cc1C.Cc1nc(Oc2ccc(-c3ccc(F)cc3)cc2)ccc1CCc1cccnc1.Cc1nc(Oc2ccc(-c3cncs3)cc2)ccc1CCc1cccnc1.Fc1cc(CCc2cccnc2)ccc1Oc1ccc(C2CCCCC2)cc1.Fc1ccc(-c2ccc(Oc3ccc(CCc4cccnc4)cc3)cc2)cc1.

What is the InChIKey of 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole?

The InChIKey is SFYNCTSEPMPEJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H25NO.2C25H21FN2O.C25H20FNO.C25H26FNO.2C22H19N3OS/c1-20-6-3-4-8-26(20)27-16-15-25(18-21(27)2)29-24-13-11-22(12-14-24)9-10-23-7-5-17-28-19-23;1-18-20(5-4-19-3-2-16-27-17-19)10-15-25(28-18)29-24-13-8-22(9-14-24)21-6-11-23(26)12-7-21;1-18-15-25(28-17-22(18)5-4-19-3-2-14-27-16-19)29-24-12-8-21(9-13-24)20-6-10-23(26)11-7-20;26-23-11-7-21(8-12-23)22-9-15-25(16-10-22)28-24-13-5-19(6-14-24)3-4-20-2-1-17-27-18-20;26-24-17-19(8-9-20-5-4-16-27-18-20)10-15-25(24)28-23-13-11-22(12-14-23)21-6-2-1-3-7-21;1-16-18(5-4-17-3-2-12-23-13-17)8-11-22(25-16)26-20-9-6-19(7-10-20)21-14-24-15-27-21;1-16-11-22(25-13-19(16)5-4-17-3-2-10-23-12-17)26-20-8-6-18(7-9-20)21-14-24-15-27-21/h3-8,11-19H,9-10H2,1-2H3;2*2-3,6-17H,4-5H2,1H3;1-2,5-18H,3-4H2;4-5,10-18,21H,1-3,6-9H2;2*2-3,6-15H,4-5H2,1H3.

What are the key properties of 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole?

3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole has a molecular weight of 2640.30 g/mol, XLogP of 43.56, 42 rotatable bonds, 0 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 3-[2-[4-(4-cyclohexylphenoxy)-3-fluorophenyl]ethyl]pyridine;2-[4-(4-fluorophenyl)phenoxy]-4-methyl-5-(2-pyridin-3-ylethyl)pyridine;6-[4-(4-fluorophenyl)phenoxy]-2-methyl-3-(2-pyridin-3-ylethyl)pyridine;3-[2-[4-[4-(4-fluorophenyl)phenoxy]phenyl]ethyl]pyridine;3-[2-[4-[3-methyl-4-(2-methylphenyl)phenoxy]phenyl]ethyl]pyridine;5-[4-[[4-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole;5-[4-[[6-methyl-5-(2-pyridin-3-ylethyl)-2-pyridinyl]oxy]phenyl]-1,3-thiazole is sourced from PubChem (CID 165067698), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).