7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol

C143H102Cl5F23N12O7 — CID 158919938

IUPAC7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol
SMILESCCOc1ccc(C(Cc2ccccn2)c2ccc3ccc(C)nc3c2O)cc1C.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2cc(C(F)(F)F)ccc2Cl)ccc2cccnc12.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2ccc(C(F)(F)F)cc2)ccc2cccnc12.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2ccc(Cl)c(Cl)c2)ccc2cccnc12.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2ccc(Cl)cc2Cl)ccc2cccnc12.Oc1c(C(Cc2ccc(F)cn2)c2ccc(C(F)(F)F)c(F)c2)ccc2cccnc12
InChIInChI=1S/C26H26N2O2.C24H15ClF6N2O.C24H16F6N2O.2C23H15Cl2F3N2O.C23H15F5N2O/c1-4-30-24-13-11-20(15-17(24)2)23(16-21-7-5-6-14-27-21)22-12-10-19-9-8-18(3)28-25(19)26(22)29;25-19-7-5-15(23(26,27)28)11-18(19)17(10-13-3-8-20(33-12-13)24(29,30)31)16-6-4-14-2-1-9-32-21(14)22(16)34;25-23(26,27)17-7-4-15(5-8-17)19(12-14-3-10-20(32-13-14)24(28,29)30)18-9-6-16-2-1-11-31-21(16)22(18)33;24-15-5-7-16(19(25)11-15)18(10-13-3-8-20(30-12-13)23(26,27)28)17-6-4-14-2-1-9-29-21(14)22(17)31;24-18-7-5-15(11-19(18)25)17(10-13-3-8-20(30-12-13)23(26,27)28)16-6-4-14-2-1-9-29-21(14)22(16)31;24-15-5-6-16(30-12-15)11-18(14-4-8-19(20(25)10-14)23(26,27)28)17-7-3-13-2-1-9-29-21(13)22(17)31/h5-15,23,29H,4,16H2,1-3H3;1-9,11-12,17,34H,10H2;1-11,13,19,33H,12H2;1-9,11-12,18,31H,10H2;1-9,11-12,17,31H,10H2;1-10,12,18,31H,11H2
InChIKeyJHSBKKNRPTYQRS-UHFFFAOYSA-N
MW2714.68 g/mol
LogP39.95
Rot. Bonds26

About 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol

7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol (PubChem CID 158919938) has the molecular formula C143H102Cl5F23N12O7 and a molecular weight of 2714.68 g/mol. Its IUPAC name is 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol.

Molecular Properties

Compound Name7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol
PubChem CID158919938
Molecular FormulaC143H102Cl5F23N12O7
Molecular Weight2714.68 g/mol
Exact Mass2710.61
IUPAC Name7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol
SMILESCCOc1ccc(C(Cc2ccccn2)c2ccc3ccc(C)nc3c2O)cc1C.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2cc(C(F)(F)F)ccc2Cl)ccc2cccnc12.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2ccc(C(F)(F)F)cc2)ccc2cccnc12.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2ccc(Cl)c(Cl)c2)ccc2cccnc12.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2ccc(Cl)cc2Cl)ccc2cccnc12.Oc1c(C(Cc2ccc(F)cn2)c2ccc(C(F)(F)F)c(F)c2)ccc2cccnc12
InChIInChI=1S/C26H26N2O2.C24H15ClF6N2O.C24H16F6N2O.2C23H15Cl2F3N2O.C23H15F5N2O/c1-4-30-24-13-11-20(15-17(24)2)23(16-21-7-5-6-14-27-21)22-12-10-19-9-8-18(3)28-25(19)26(22)29;25-19-7-5-15(23(26,27)28)11-18(19)17(10-13-3-8-20(33-12-13)24(29,30)31)16-6-4-14-2-1-9-32-21(14)22(16)34;25-23(26,27)17-7-4-15(5-8-17)19(12-14-3-10-20(32-13-14)24(28,29)30)18-9-6-16-2-1-11-31-21(16)22(18)33;24-15-5-7-16(19(25)11-15)18(10-13-3-8-20(30-12-13)23(26,27)28)17-6-4-14-2-1-9-29-21(14)22(17)31;24-18-7-5-15(11-19(18)25)17(10-13-3-8-20(30-12-13)23(26,27)28)16-6-4-14-2-1-9-29-21(14)22(16)31;24-15-5-6-16(30-12-15)11-18(14-4-8-19(20(25)10-14)23(26,27)28)17-7-3-13-2-1-9-29-21(13)22(17)31/h5-15,23,29H,4,16H2,1-3H3;1-9,11-12,17,34H,10H2;1-11,13,19,33H,12H2;1-9,11-12,18,31H,10H2;1-9,11-12,17,31H,10H2;1-10,12,18,31H,11H2
InChIKeyJHSBKKNRPTYQRS-UHFFFAOYSA-N
XLogP39.95
TPSA285.29 Ų
H-Bond Donors6
H-Bond Acceptors19
Rotatable Bonds26
Heavy Atoms190
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002714.68
LogP ≤ 539.95
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1019

Analyze 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol?
The IUPAC name of 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol (CID 158919938) is 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol.
What is the SMILES notation for 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol?
The canonical SMILES for 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol is CCOc1ccc(C(Cc2ccccn2)c2ccc3ccc(C)nc3c2O)cc1C.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2cc(C(F)(F)F)ccc2Cl)ccc2cccnc12.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2ccc(C(F)(F)F)cc2)ccc2cccnc12.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2ccc(Cl)c(Cl)c2)ccc2cccnc12.Oc1c(C(Cc2ccc(C(F)(F)F)nc2)c2ccc(Cl)cc2Cl)ccc2cccnc12.Oc1c(C(Cc2ccc(F)cn2)c2ccc(C(F)(F)F)c(F)c2)ccc2cccnc12.
What is the InChIKey of 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol?
The InChIKey is JHSBKKNRPTYQRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26N2O2.C24H15ClF6N2O.C24H16F6N2O.2C23H15Cl2F3N2O.C23H15F5N2O/c1-4-30-24-13-11-20(15-17(24)2)23(16-21-7-5-6-14-27-21)22-12-10-19-9-8-18(3)28-25(19)26(22)29;25-19-7-5-15(23(26,27)28)11-18(19)17(10-13-3-8-20(33-12-13)24(29,30)31)16-6-4-14-2-1-9-32-21(14)22(16)34;25-23(26,27)17-7-4-15(5-8-17)19(12-14-3-10-20(32-13-14)24(28,29)30)18-9-6-16-2-1-11-31-21(16)22(18)33;24-15-5-7-16(19(25)11-15)18(10-13-3-8-20(30-12-13)23(26,27)28)17-6-4-14-2-1-9-29-21(14)22(17)31;24-18-7-5-15(11-19(18)25)17(10-13-3-8-20(30-12-13)23(26,27)28)16-6-4-14-2-1-9-29-21(14)22(16)31;24-15-5-6-16(30-12-15)11-18(14-4-8-19(20(25)10-14)23(26,27)28)17-7-3-13-2-1-9-29-21(13)22(17)31/h5-15,23,29H,4,16H2,1-3H3;1-9,11-12,17,34H,10H2;1-11,13,19,33H,12H2;1-9,11-12,18,31H,10H2;1-9,11-12,17,31H,10H2;1-10,12,18,31H,11H2.
What are the key properties of 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol?
7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol has a molecular weight of 2714.68 g/mol, XLogP of 39.95, 26 rotatable bonds, 6 hydrogen bond donors, and 19 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-[2-chloro-5-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(2,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(3,4-dichlorophenyl)-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol;7-[1-(4-ethoxy-3-methylphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol;7-[2-(5-fluoro-2-pyridinyl)-1-[3-fluoro-4-(trifluoromethyl)phenyl]ethyl]quinolin-8-ol;7-[1-[4-(trifluoromethyl)phenyl]-2-[6-(trifluoromethyl)-3-pyridinyl]ethyl]quinolin-8-ol is sourced from PubChem (CID 158919938), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).