7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol

C138H117Cl4N13O12 — CID 162214054

IUPAC7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol
SMILESCOc1ccc(C(Cc2ccccn2)c2ccc3ccc(C)nc3c2O)cc1.Cc1cc2ccc(C(Cc3ncccc3O)c3ccc(Cl)cc3)c(O)c2nc1C.Cc1ccc2ccc(C(Cc3ncccc3O)c3ccc(Cl)cc3)c(O)c2n1.Cc1ccc2ccc(C(Cc3ncccc3O)c3cccnc3)c(O)c2n1.Cc1cnc2c(O)c(C(Cc3ncccc3O)c3ccc(Cl)cc3)ccc2c1.Oc1cccnc1CC(c1ccc(Cl)cc1)c1ccc2cccnc2c1O
InChIInChI=1S/C24H21ClN2O2.C24H22N2O2.2C23H19ClN2O2.C22H17ClN2O2.C22H19N3O2/c1-14-12-17-7-10-19(24(29)23(17)27-15(14)2)20(16-5-8-18(25)9-6-16)13-21-22(28)4-3-11-26-21;1-16-6-7-18-10-13-21(24(27)23(18)26-16)22(15-19-5-3-4-14-25-19)17-8-11-20(28-2)12-9-17;1-14-11-16-6-9-18(23(28)22(16)26-13-14)19(15-4-7-17(24)8-5-15)12-20-21(27)3-2-10-25-20;1-14-4-5-16-8-11-18(23(28)22(16)26-14)19(15-6-9-17(24)10-7-15)13-20-21(27)3-2-12-25-20;23-16-8-5-14(6-9-16)18(13-19-20(26)4-2-11-24-19)17-10-7-15-3-1-12-25-21(15)22(17)27;1-14-6-7-15-8-9-17(22(27)21(15)25-14)18(16-4-2-10-23-13-16)12-19-20(26)5-3-11-24-19/h3-12,20,28-29H,13H2,1-2H3;3-14,22,27H,15H2,1-2H3;2-11,13,19,27-28H,12H2,1H3;2-12,19,27-28H,13H2,1H3;1-12,18,26-27H,13H2;2-11,13,18,26-27H,12H2,1H3
InChIKeyZTFSVVJDGFRVGY-UHFFFAOYSA-N
MW2291.34 g/mol
LogP30.66
Rot. Bonds25

About 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol

7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol (PubChem CID 162214054) has the molecular formula C138H117Cl4N13O12 and a molecular weight of 2291.34 g/mol. Its IUPAC name is 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol.

Molecular Properties

Compound Name7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol
PubChem CID162214054
Molecular FormulaC138H117Cl4N13O12
Molecular Weight2291.34 g/mol
Exact Mass2287.77
IUPAC Name7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol
SMILESCOc1ccc(C(Cc2ccccn2)c2ccc3ccc(C)nc3c2O)cc1.Cc1cc2ccc(C(Cc3ncccc3O)c3ccc(Cl)cc3)c(O)c2nc1C.Cc1ccc2ccc(C(Cc3ncccc3O)c3ccc(Cl)cc3)c(O)c2n1.Cc1ccc2ccc(C(Cc3ncccc3O)c3cccnc3)c(O)c2n1.Cc1cnc2c(O)c(C(Cc3ncccc3O)c3ccc(Cl)cc3)ccc2c1.Oc1cccnc1CC(c1ccc(Cl)cc1)c1ccc2cccnc2c1O
InChIInChI=1S/C24H21ClN2O2.C24H22N2O2.2C23H19ClN2O2.C22H17ClN2O2.C22H19N3O2/c1-14-12-17-7-10-19(24(29)23(17)27-15(14)2)20(16-5-8-18(25)9-6-16)13-21-22(28)4-3-11-26-21;1-16-6-7-18-10-13-21(24(27)23(18)26-16)22(15-19-5-3-4-14-25-19)17-8-11-20(28-2)12-9-17;1-14-11-16-6-9-18(23(28)22(16)26-13-14)19(15-4-7-17(24)8-5-15)12-20-21(27)3-2-10-25-20;1-14-4-5-16-8-11-18(23(28)22(16)26-14)19(15-6-9-17(24)10-7-15)13-20-21(27)3-2-12-25-20;23-16-8-5-14(6-9-16)18(13-19-20(26)4-2-11-24-19)17-10-7-15-3-1-12-25-21(15)22(17)27;1-14-6-7-15-8-9-17(22(27)21(15)25-14)18(16-4-2-10-23-13-16)12-19-20(26)5-3-11-24-19/h3-12,20,28-29H,13H2,1-2H3;3-14,22,27H,15H2,1-2H3;2-11,13,19,27-28H,12H2,1H3;2-12,19,27-28H,13H2,1H3;1-12,18,26-27H,13H2;2-11,13,18,26-27H,12H2,1H3
InChIKeyZTFSVVJDGFRVGY-UHFFFAOYSA-N
XLogP30.66
TPSA399.33 Ų
H-Bond Donors11
H-Bond Acceptors25
Rotatable Bonds25
Heavy Atoms167
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002291.34
LogP ≤ 530.66
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1025

Analyze 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol?
The IUPAC name of 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol (CID 162214054) is 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol.
What is the SMILES notation for 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol?
The canonical SMILES for 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol is COc1ccc(C(Cc2ccccn2)c2ccc3ccc(C)nc3c2O)cc1.Cc1cc2ccc(C(Cc3ncccc3O)c3ccc(Cl)cc3)c(O)c2nc1C.Cc1ccc2ccc(C(Cc3ncccc3O)c3ccc(Cl)cc3)c(O)c2n1.Cc1ccc2ccc(C(Cc3ncccc3O)c3cccnc3)c(O)c2n1.Cc1cnc2c(O)c(C(Cc3ncccc3O)c3ccc(Cl)cc3)ccc2c1.Oc1cccnc1CC(c1ccc(Cl)cc1)c1ccc2cccnc2c1O.
What is the InChIKey of 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol?
The InChIKey is ZTFSVVJDGFRVGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21ClN2O2.C24H22N2O2.2C23H19ClN2O2.C22H17ClN2O2.C22H19N3O2/c1-14-12-17-7-10-19(24(29)23(17)27-15(14)2)20(16-5-8-18(25)9-6-16)13-21-22(28)4-3-11-26-21;1-16-6-7-18-10-13-21(24(27)23(18)26-16)22(15-19-5-3-4-14-25-19)17-8-11-20(28-2)12-9-17;1-14-11-16-6-9-18(23(28)22(16)26-13-14)19(15-4-7-17(24)8-5-15)12-20-21(27)3-2-10-25-20;1-14-4-5-16-8-11-18(23(28)22(16)26-14)19(15-6-9-17(24)10-7-15)13-20-21(27)3-2-12-25-20;23-16-8-5-14(6-9-16)18(13-19-20(26)4-2-11-24-19)17-10-7-15-3-1-12-25-21(15)22(17)27;1-14-6-7-15-8-9-17(22(27)21(15)25-14)18(16-4-2-10-23-13-16)12-19-20(26)5-3-11-24-19/h3-12,20,28-29H,13H2,1-2H3;3-14,22,27H,15H2,1-2H3;2-11,13,19,27-28H,12H2,1H3;2-12,19,27-28H,13H2,1H3;1-12,18,26-27H,13H2;2-11,13,18,26-27H,12H2,1H3.
What are the key properties of 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol?
7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol has a molecular weight of 2291.34 g/mol, XLogP of 30.66, 25 rotatable bonds, 11 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2,3-dimethylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-2-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]-3-methylquinolin-8-ol;7-[1-(4-chlorophenyl)-2-(3-hydroxy-2-pyridinyl)ethyl]quinolin-8-ol;7-[2-(3-hydroxy-2-pyridinyl)-1-pyridin-3-ylethyl]-2-methylquinolin-8-ol;7-[1-(4-methoxyphenyl)-2-pyridin-2-ylethyl]-2-methylquinolin-8-ol is sourced from PubChem (CID 162214054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).