7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol

C116H82Cl6F14N10O6 — CID 161430793

About 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol

7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol (PubChem CID 161430793) has the molecular formula C116H82Cl6F14N10O6 and a molecular weight of 2190.69 g/mol. Its IUPAC name is 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol.

Molecular Properties

• Compound Name: 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol
• PubChem CID: 161430793
• Molecular Formula: C116H82Cl6F14N10O6
• Molecular Weight: 2190.69 g/mol
• Exact Mass: 2186.43
• IUPAC Name: 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol
• SMILES: Cc1ccc2ccc(C(Cc3cccnc3)c3c(F)c(F)c(OCC(F)(F)F)c(F)c3F)c(O)c2n1.Cc1ccnc(CC(c2ccc(C(F)(F)F)cc2F)c2ccc3ccc(C)nc3c2O)c1.Oc1c(C(Cc2ccc(Cl)cn2)c2cc(Cl)ccc2Cl)ccc2cccnc12.Oc1c(C(Cc2ccc(F)cn2)c2cc(Cl)ccc2Cl)ccc2cccnc12.Oc1c(C(Cc2ccc(F)cn2)c2ccc(F)cc2Cl)ccc2cccnc12
• InChI: InChI=1S/C25H17F7N2O2.C25H20F4N2O.C22H15Cl3N2O.C22H15Cl2FN2O.C22H15ClF2N2O/c1-12-4-5-14-6-7-15(23(35)22(14)34-12)16(9-13-3-2-8-33-10-13)17-18(26)20(28)24(21(29)19(17)27)36-11-25(30,31)32;1-14-9-10-30-18(11-14)13-21(19-8-6-17(12-22(19)26)25(27,28)29)20-7-5-16-4-3-15(2)31-23(16)24(20)32;23-14-5-8-20(25)19(10-14)18(11-16-6-4-15(24)12-27-16)17-7-3-13-2-1-9-26-21(13)22(17)28;23-14-4-8-20(24)19(10-14)18(11-16-6-5-15(25)12-27-16)17-7-3-13-2-1-9-26-21(13)22(17)28;23-20-10-14(24)5-8-17(20)19(11-16-6-4-15(25)12-27-16)18-7-3-13-2-1-9-26-21(13)22(18)28/h2-8,10,16,35H,9,11H2,1H3;3-12,21,32H,13H2,1-2H3;2*1-10,12,18,28H,11H2;1-10,12,19,28H,11H2
• InChIKey: VXZDBTUVSZTZIH-UHFFFAOYSA-N
• XLogP: 31.47
• TPSA: 239.28 Ų
• H-Bond Donors: 5
• H-Bond Acceptors: 16
• Rotatable Bonds: 22
• Heavy Atoms: 152
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2190.69
LogP ≤ 5	31.47
H-Bond Donors ≤ 5	5
H-Bond Acceptors ≤ 10	16

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol?

The IUPAC name of 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol (CID 161430793) is 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol.

What is the SMILES notation for 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol?

The canonical SMILES for 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol is Cc1ccc2ccc(C(Cc3cccnc3)c3c(F)c(F)c(OCC(F)(F)F)c(F)c3F)c(O)c2n1.Cc1ccnc(CC(c2ccc(C(F)(F)F)cc2F)c2ccc3ccc(C)nc3c2O)c1.Oc1c(C(Cc2ccc(Cl)cn2)c2cc(Cl)ccc2Cl)ccc2cccnc12.Oc1c(C(Cc2ccc(F)cn2)c2cc(Cl)ccc2Cl)ccc2cccnc12.Oc1c(C(Cc2ccc(F)cn2)c2ccc(F)cc2Cl)ccc2cccnc12.

What is the InChIKey of 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol?

The InChIKey is VXZDBTUVSZTZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H17F7N2O2.C25H20F4N2O.C22H15Cl3N2O.C22H15Cl2FN2O.C22H15ClF2N2O/c1-12-4-5-14-6-7-15(23(35)22(14)34-12)16(9-13-3-2-8-33-10-13)17-18(26)20(28)24(21(29)19(17)27)36-11-25(30,31)32;1-14-9-10-30-18(11-14)13-21(19-8-6-17(12-22(19)26)25(27,28)29)20-7-5-16-4-3-15(2)31-23(16)24(20)32;23-14-5-8-20(25)19(10-14)18(11-16-6-4-15(24)12-27-16)17-7-3-13-2-1-9-26-21(13)22(17)28;23-14-4-8-20(24)19(10-14)18(11-16-6-5-15(25)12-27-16)17-7-3-13-2-1-9-26-21(13)22(17)28;23-20-10-14(24)5-8-17(20)19(11-16-6-4-15(25)12-27-16)18-7-3-13-2-1-9-26-21(13)22(18)28/h2-8,10,16,35H,9,11H2,1H3;3-12,21,32H,13H2,1-2H3;2*1-10,12,18,28H,11H2;1-10,12,19,28H,11H2.

What are the key properties of 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol?

7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol has a molecular weight of 2190.69 g/mol, XLogP of 31.47, 22 rotatable bonds, 5 hydrogen bond donors, and 16 hydrogen bond acceptors.

Where does this data come from?

All data for 7-[1-(2-chloro-4-fluorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(5-chloro-2-pyridinyl)-1-(2,5-dichlorophenyl)ethyl]quinolin-8-ol;7-[1-(2,5-dichlorophenyl)-2-(5-fluoro-2-pyridinyl)ethyl]quinolin-8-ol;7-[1-[2-fluoro-4-(trifluoromethyl)phenyl]-2-(4-methyl-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;2-methyl-7-[2-pyridin-3-yl-1-[2,3,5,6-tetrafluoro-4-(2,2,2-trifluoroethoxy)phenyl]ethyl]quinolin-8-ol is sourced from PubChem (CID 161430793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).