3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide

C143H118BrClF4N18O15 — CID 167693348

IUPAC3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide
SMILESCOc1cc2nccc(Oc3cccc(C(=O)NCc4ccncc4)c3C)c2cc1Br.COc1cc2nccc(Oc3cccc(C(=O)NCc4ccncc4)c3C)c2cc1OC.Cc1c(Oc2ccnc3c(C)cccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3c(Cl)cccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3c(F)cccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3cc(C(F)(F)F)ccc23)cccc1C(=O)NCc1ccncc1
InChIInChI=1S/C25H23N3O4.C24H20BrN3O3.C24H18F3N3O2.C24H21N3O2.C23H18ClN3O2.C23H18FN3O2/c1-16-18(25(29)28-15-17-7-10-26-11-8-17)5-4-6-21(16)32-22-9-12-27-20-14-24(31-3)23(30-2)13-19(20)22;1-15-17(24(29)28-14-16-6-9-26-10-7-16)4-3-5-21(15)31-22-8-11-27-20-13-23(30-2)19(25)12-18(20)22;1-15-18(23(31)30-14-16-7-10-28-11-8-16)3-2-4-21(15)32-22-9-12-29-20-13-17(24(25,26)27)5-6-19(20)22;1-16-5-3-7-20-22(11-14-26-23(16)20)29-21-8-4-6-19(17(21)2)24(28)27-15-18-9-12-25-13-10-18;2*1-15-17(23(28)27-14-16-8-11-25-12-9-16)4-3-7-20(15)29-21-10-13-26-22-18(21)5-2-6-19(22)24/h4-14H,15H2,1-3H3,(H,28,29);3-13H,14H2,1-2H3,(H,28,29);2-13H,14H2,1H3,(H,30,31);3-14H,15H2,1-2H3,(H,27,28);2*2-13H,14H2,1H3,(H,27,28)
InChIKeyXGXIVPQOZLDFCI-UHFFFAOYSA-N
MW2519.98 g/mol
LogP30.87
Rot. Bonds33

About 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide

3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide (PubChem CID 167693348) has the molecular formula C143H118BrClF4N18O15 and a molecular weight of 2519.98 g/mol. Its IUPAC name is 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide.

Molecular Properties

Compound Name3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide
PubChem CID167693348
Molecular FormulaC143H118BrClF4N18O15
Molecular Weight2519.98 g/mol
Exact Mass2516.78
IUPAC Name3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide
SMILESCOc1cc2nccc(Oc3cccc(C(=O)NCc4ccncc4)c3C)c2cc1Br.COc1cc2nccc(Oc3cccc(C(=O)NCc4ccncc4)c3C)c2cc1OC.Cc1c(Oc2ccnc3c(C)cccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3c(Cl)cccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3c(F)cccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3cc(C(F)(F)F)ccc23)cccc1C(=O)NCc1ccncc1
InChIInChI=1S/C25H23N3O4.C24H20BrN3O3.C24H18F3N3O2.C24H21N3O2.C23H18ClN3O2.C23H18FN3O2/c1-16-18(25(29)28-15-17-7-10-26-11-8-17)5-4-6-21(16)32-22-9-12-27-20-14-24(31-3)23(30-2)13-19(20)22;1-15-17(24(29)28-14-16-6-9-26-10-7-16)4-3-5-21(15)31-22-8-11-27-20-13-23(30-2)19(25)12-18(20)22;1-15-18(23(31)30-14-16-7-10-28-11-8-16)3-2-4-21(15)32-22-9-12-29-20-13-17(24(25,26)27)5-6-19(20)22;1-16-5-3-7-20-22(11-14-26-23(16)20)29-21-8-4-6-19(17(21)2)24(28)27-15-18-9-12-25-13-10-18;2*1-15-17(23(28)27-14-16-8-11-25-12-9-16)4-3-7-20(15)29-21-10-13-26-22-18(21)5-2-6-19(22)24/h4-14H,15H2,1-3H3,(H,28,29);3-13H,14H2,1-2H3,(H,28,29);2-13H,14H2,1H3,(H,30,31);3-14H,15H2,1-2H3,(H,27,28);2*2-13H,14H2,1H3,(H,27,28)
InChIKeyXGXIVPQOZLDFCI-UHFFFAOYSA-N
XLogP30.87
TPSA412.35 Ų
H-Bond Donors6
H-Bond Acceptors27
Rotatable Bonds33
Heavy Atoms182
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002519.98
LogP ≤ 530.87
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1027

Analyze 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide?
The IUPAC name of 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide (CID 167693348) is 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide.
What is the SMILES notation for 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide?
The canonical SMILES for 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide is COc1cc2nccc(Oc3cccc(C(=O)NCc4ccncc4)c3C)c2cc1Br.COc1cc2nccc(Oc3cccc(C(=O)NCc4ccncc4)c3C)c2cc1OC.Cc1c(Oc2ccnc3c(C)cccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3c(Cl)cccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3c(F)cccc23)cccc1C(=O)NCc1ccncc1.Cc1c(Oc2ccnc3cc(C(F)(F)F)ccc23)cccc1C(=O)NCc1ccncc1.
What is the InChIKey of 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide?
The InChIKey is XGXIVPQOZLDFCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H23N3O4.C24H20BrN3O3.C24H18F3N3O2.C24H21N3O2.C23H18ClN3O2.C23H18FN3O2/c1-16-18(25(29)28-15-17-7-10-26-11-8-17)5-4-6-21(16)32-22-9-12-27-20-14-24(31-3)23(30-2)13-19(20)22;1-15-17(24(29)28-14-16-6-9-26-10-7-16)4-3-5-21(15)31-22-8-11-27-20-13-23(30-2)19(25)12-18(20)22;1-15-18(23(31)30-14-16-7-10-28-11-8-16)3-2-4-21(15)32-22-9-12-29-20-13-17(24(25,26)27)5-6-19(20)22;1-16-5-3-7-20-22(11-14-26-23(16)20)29-21-8-4-6-19(17(21)2)24(28)27-15-18-9-12-25-13-10-18;2*1-15-17(23(28)27-14-16-8-11-25-12-9-16)4-3-7-20(15)29-21-10-13-26-22-18(21)5-2-6-19(22)24/h4-14H,15H2,1-3H3,(H,28,29);3-13H,14H2,1-2H3,(H,28,29);2-13H,14H2,1H3,(H,30,31);3-14H,15H2,1-2H3,(H,27,28);2*2-13H,14H2,1H3,(H,27,28).
What are the key properties of 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide?
3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide has a molecular weight of 2519.98 g/mol, XLogP of 30.87, 33 rotatable bonds, 6 hydrogen bond donors, and 27 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(6-bromo-7-methoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-chloroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(6,7-dimethoxyquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;3-(8-fluoroquinolin-4-yl)oxy-2-methyl-N-(pyridin-4-ylmethyl)benzamide;2-methyl-3-(8-methylquinolin-4-yl)oxy-N-(pyridin-4-ylmethyl)benzamide;2-methyl-N-(pyridin-4-ylmethyl)-3-[7-(trifluoromethyl)quinolin-4-yl]oxybenzamide is sourced from PubChem (CID 167693348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).