4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide

C238H252Cl8N28O34 — CID 158279843

IUPAC4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide
SMILESCC(C)Oc1cc2nccc(Oc3ccc(CC(=O)CC4=CC(C(C)(C)C)=NC4)c(Cl)c3)c2cc1C(N)=O.CCn1nc(C(C)(C)C)cc1CC(=O)Cc1ccc(Oc2ccnc3cc(OC)c(C(=O)NC)cc23)cc1Cl.CNC(=O)c1cc2c(Oc3ccc(CC(=O)CC4=CC(C(C)(C)C)=NC4)c(Cl)c3)ccnc2cc1OC.CNC(=O)c1cc2c(Oc3ccc(CC(=O)Cc4cc(C(C)(C)C)nn4C)c(Cl)c3)ccnc2cc1OC.CNC(=O)c1cc2c(Oc3ccc(CC(=O)Cc4cc(C(C)(C)C)nn4C4CCCC4)c(Cl)c3)ccnc2cc1OC.COCCOc1cc2nccc(Oc3ccc(CC(=O)CC4=CC(C(C)(C)C)=NC4)c(Cl)c3)c2cc1C(N)=O.COCCOc1cc2nccc(Oc3ccc(CC(=O)Cc4cc(C(C)(C)C)nn4C)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(CC(=O)CC4=CC(C5CC5)=NC4)c(Cl)c3)c2cc1C(N)=O
InChIInChI=1S/C33H37ClN4O4.C30H33ClN4O5.C30H33ClN4O4.C30H32ClN3O5.C30H32ClN3O4.C29H31ClN4O4.C29H30ClN3O4.C27H24ClN3O4/c1-33(2,3)31-16-22(38(37-31)21-8-6-7-9-21)15-23(39)14-20-10-11-24(17-27(20)34)42-29-12-13-36-28-19-30(41-5)26(18-25(28)29)32(40)35-4;1-30(2,3)28-14-19(35(4)34-28)13-20(36)12-18-6-7-21(15-24(18)31)40-26-8-9-33-25-17-27(39-11-10-38-5)23(29(32)37)16-22(25)26;1-7-35-19(14-28(34-35)30(2,3)4)13-20(36)12-18-8-9-21(15-24(18)31)39-26-10-11-33-25-17-27(38-6)23(16-22(25)26)29(37)32-5;1-30(2,3)28-12-18(17-34-28)11-20(35)13-19-5-6-21(14-24(19)31)39-26-7-8-33-25-16-27(38-10-9-37-4)23(29(32)36)15-22(25)26;1-17(2)37-27-15-25-22(14-23(27)29(32)36)26(8-9-33-25)38-21-7-6-19(24(31)13-21)12-20(35)10-18-11-28(34-16-18)30(3,4)5;1-29(2,3)27-13-18(34(5)33-27)12-19(35)11-17-7-8-20(14-23(17)30)38-25-9-10-32-24-16-26(37-6)22(15-21(24)25)28(36)31-4;1-29(2,3)27-11-17(16-33-27)10-19(34)12-18-6-7-20(13-23(18)30)37-25-8-9-32-24-15-26(36-5)22(14-21(24)25)28(35)31-4;1-34-26-13-24-20(12-21(26)27(29)33)25(6-7-30-24)35-19-5-4-17(22(28)11-19)10-18(32)8-15-9-23(31-14-15)16-2-3-16/h10-13,16-19,21H,6-9,14-15H2,1-5H3,(H,35,40);6-9,14-17H,10-13H2,1-5H3,(H2,32,37);8-11,14-17H,7,12-13H2,1-6H3,(H,32,37);5-8,12,14-16H,9-11,13,17H2,1-4H3,(H2,32,36);6-9,11,13-15,17H,10,12,16H2,1-5H3,(H2,32,36);7-10,13-16H,11-12H2,1-6H3,(H,31,36);6-9,11,13-15H,10,12,16H2,1-5H3,(H,31,35);4-7,9,11-13,16H,2-3,8,10,14H2,1H3,(H2,29,33)
InChIKeyGKBQVNZMIRULQG-UHFFFAOYSA-N
MW4332.42 g/mol
LogP46.84
Rot. Bonds74

About 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide

4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide (PubChem CID 158279843) has the molecular formula C238H252Cl8N28O34 and a molecular weight of 4332.42 g/mol. Its IUPAC name is 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide.

Molecular Properties

Compound Name4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide
PubChem CID158279843
Molecular FormulaC238H252Cl8N28O34
Molecular Weight4332.42 g/mol
Exact Mass4325.64
IUPAC Name4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide
SMILESCC(C)Oc1cc2nccc(Oc3ccc(CC(=O)CC4=CC(C(C)(C)C)=NC4)c(Cl)c3)c2cc1C(N)=O.CCn1nc(C(C)(C)C)cc1CC(=O)Cc1ccc(Oc2ccnc3cc(OC)c(C(=O)NC)cc23)cc1Cl.CNC(=O)c1cc2c(Oc3ccc(CC(=O)CC4=CC(C(C)(C)C)=NC4)c(Cl)c3)ccnc2cc1OC.CNC(=O)c1cc2c(Oc3ccc(CC(=O)Cc4cc(C(C)(C)C)nn4C)c(Cl)c3)ccnc2cc1OC.CNC(=O)c1cc2c(Oc3ccc(CC(=O)Cc4cc(C(C)(C)C)nn4C4CCCC4)c(Cl)c3)ccnc2cc1OC.COCCOc1cc2nccc(Oc3ccc(CC(=O)CC4=CC(C(C)(C)C)=NC4)c(Cl)c3)c2cc1C(N)=O.COCCOc1cc2nccc(Oc3ccc(CC(=O)Cc4cc(C(C)(C)C)nn4C)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(CC(=O)CC4=CC(C5CC5)=NC4)c(Cl)c3)c2cc1C(N)=O
InChIInChI=1S/C33H37ClN4O4.C30H33ClN4O5.C30H33ClN4O4.C30H32ClN3O5.C30H32ClN3O4.C29H31ClN4O4.C29H30ClN3O4.C27H24ClN3O4/c1-33(2,3)31-16-22(38(37-31)21-8-6-7-9-21)15-23(39)14-20-10-11-24(17-27(20)34)42-29-12-13-36-28-19-30(41-5)26(18-25(28)29)32(40)35-4;1-30(2,3)28-14-19(35(4)34-28)13-20(36)12-18-6-7-21(15-24(18)31)40-26-8-9-33-25-17-27(39-11-10-38-5)23(29(32)37)16-22(25)26;1-7-35-19(14-28(34-35)30(2,3)4)13-20(36)12-18-8-9-21(15-24(18)31)39-26-10-11-33-25-17-27(38-6)23(16-22(25)26)29(37)32-5;1-30(2,3)28-12-18(17-34-28)11-20(35)13-19-5-6-21(14-24(19)31)39-26-7-8-33-25-16-27(38-10-9-37-4)23(29(32)36)15-22(25)26;1-17(2)37-27-15-25-22(14-23(27)29(32)36)26(8-9-33-25)38-21-7-6-19(24(31)13-21)12-20(35)10-18-11-28(34-16-18)30(3,4)5;1-29(2,3)27-13-18(34(5)33-27)12-19(35)11-17-7-8-20(14-23(17)30)38-25-9-10-32-24-16-26(37-6)22(15-21(24)25)28(36)31-4;1-29(2,3)27-11-17(16-33-27)10-19(34)12-18-6-7-20(13-23(18)30)37-25-8-9-32-24-15-26(36-5)22(14-21(24)25)28(35)31-4;1-34-26-13-24-20(12-21(26)27(29)33)25(6-7-30-24)35-19-5-4-17(22(28)11-19)10-18(32)8-15-9-23(31-14-15)16-2-3-16/h10-13,16-19,21H,6-9,14-15H2,1-5H3,(H,35,40);6-9,14-17H,10-13H2,1-5H3,(H2,32,37);8-11,14-17H,7,12-13H2,1-6H3,(H,32,37);5-8,12,14-16H,9-11,13,17H2,1-4H3,(H2,32,36);6-9,11,13-15,17H,10,12,16H2,1-5H3,(H2,32,36);7-10,13-16H,11-12H2,1-6H3,(H,31,36);6-9,11,13-15H,10,12,16H2,1-5H3,(H,31,35);4-7,9,11-13,16H,2-3,8,10,14H2,1H3,(H2,29,33)
InChIKeyGKBQVNZMIRULQG-UHFFFAOYSA-N
XLogP46.84
TPSA815.30 Ų
H-Bond Donors8
H-Bond Acceptors54
Rotatable Bonds74
Heavy Atoms308
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004332.42
LogP ≤ 546.84
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1054

Analyze 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide with MolForge

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Related Compounds

4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-2-chloro-7-methoxyquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-2,3-dichlorophenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-2-chlorophenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-2,3-dichlorophenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-2-methylphenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-methylphenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-(trifluoromethyl)phenoxy]-7-methoxyquinoline-6-carboxamide
CID 158002189
4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-2-chloro-7-methoxyquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-2,3-dichlorophenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-2-chlorophenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-2,3-dichlorophenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-2-methylphenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-methylphenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-(trifluoromethyl)phenoxy]-7-methoxyquinoline-6-carboxamide;4-[3-chloro-4-[2-oxo-3-(5-propan-2-yl-2H-pyrrol-3-yl)propyl]phenoxy]-7-methoxyquinoline-6-carboxamide
CID 160780959
4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chloro-2-methylphenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-2,3-dimethylphenoxy]-7-methoxyquinoline-6-carboxamide;1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[2-chloro-4-(8-fluoroquinolin-4-yl)oxyphenyl]propan-2-one;1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[2-chloro-4-[2-(trifluoromethyl)quinolin-4-yl]oxyphenyl]propan-2-one;1-(5-tert-butyl-2H-pyrrol-3-yl)-3-[2-chloro-4-[8-(trifluoromethyl)quinolin-4-yl]oxyphenyl]propan-2-one;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chloro-2-methylphenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-2,3-dimethylphenoxy]-7-methoxyquinoline-6-carboxamide;4-[[5-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-2-pyridinyl]oxy]-7-methoxyquinoline-6-carboxamide
CID 161047628
CID 161049784
CID 161049784
4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chloro-2-methylphenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-2,3-dimethylphenoxy]-7-methoxyquinoline-6-carboxamide;1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[2-chloro-4-(8-fluoroquinolin-4-yl)oxyphenyl]propan-2-one;1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[2-chloro-4-[2-(trifluoromethyl)quinolin-4-yl]oxyphenyl]propan-2-one;1-(5-tert-butyl-1,2-oxazol-3-yl)-3-[2-chloro-4-[8-(trifluoromethyl)quinolin-4-yl]oxyphenyl]propan-2-one;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chloro-2-methylphenoxy]-7-methoxyquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-2,3-dimethylphenoxy]-7-methoxyquinoline-6-carboxamide;4-[[5-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-2-pyridinyl]oxy]-7-methoxyquinoline-6-carboxamide
CID 161264336
4-[4-[3-(3-Tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxyquinoline-6-carboxamide
CID 147904796
4-[4-[3-(3-Tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-[3-(4-methylpiperazin-1-yl)propoxy]quinoline-6-carboxamide
CID 153293906
bis(3-tert-butyl-1-methylpyrazol-5-amine);4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxyquinoline-6-carboxamide;N,N-diethylethanamine;ethanamine;ethanol;1-isocyano-3,3-dimethylbutan-2-one;oxolane;phenyl 2-[4-(6-carbamoyl-7-methoxyquinolin-4-yl)oxy-2-chlorophenyl]acetate;sulfuric acid
CID 157312668
CID 157569476
CID 157569476
4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)-N-methylquinoline-6-carboxamide
CID 157569483
4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide
CID 157686344
4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(1,1,2,2,3,3-hexadeuterio-3-morpholin-4-ylpropoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-[1,1,2,2,3,3-hexadeuterio-3-[4-(trideuteriomethyl)piperazin-1-yl]propoxy]quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(1,1,2,2,3,3-hexadeuterio-3-morpholin-4-ylpropoxy)quinoline-6-carboxamide
CID 157774371

Frequently Asked Questions

What is the IUPAC name of 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide?
The IUPAC name of 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide (CID 158279843) is 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide.
What is the SMILES notation for 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide?
The canonical SMILES for 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide is CC(C)Oc1cc2nccc(Oc3ccc(CC(=O)CC4=CC(C(C)(C)C)=NC4)c(Cl)c3)c2cc1C(N)=O.CCn1nc(C(C)(C)C)cc1CC(=O)Cc1ccc(Oc2ccnc3cc(OC)c(C(=O)NC)cc23)cc1Cl.CNC(=O)c1cc2c(Oc3ccc(CC(=O)CC4=CC(C(C)(C)C)=NC4)c(Cl)c3)ccnc2cc1OC.CNC(=O)c1cc2c(Oc3ccc(CC(=O)Cc4cc(C(C)(C)C)nn4C)c(Cl)c3)ccnc2cc1OC.CNC(=O)c1cc2c(Oc3ccc(CC(=O)Cc4cc(C(C)(C)C)nn4C4CCCC4)c(Cl)c3)ccnc2cc1OC.COCCOc1cc2nccc(Oc3ccc(CC(=O)CC4=CC(C(C)(C)C)=NC4)c(Cl)c3)c2cc1C(N)=O.COCCOc1cc2nccc(Oc3ccc(CC(=O)Cc4cc(C(C)(C)C)nn4C)c(Cl)c3)c2cc1C(N)=O.COc1cc2nccc(Oc3ccc(CC(=O)CC4=CC(C5CC5)=NC4)c(Cl)c3)c2cc1C(N)=O.
What is the InChIKey of 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide?
The InChIKey is GKBQVNZMIRULQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H37ClN4O4.C30H33ClN4O5.C30H33ClN4O4.C30H32ClN3O5.C30H32ClN3O4.C29H31ClN4O4.C29H30ClN3O4.C27H24ClN3O4/c1-33(2,3)31-16-22(38(37-31)21-8-6-7-9-21)15-23(39)14-20-10-11-24(17-27(20)34)42-29-12-13-36-28-19-30(41-5)26(18-25(28)29)32(40)35-4;1-30(2,3)28-14-19(35(4)34-28)13-20(36)12-18-6-7-21(15-24(18)31)40-26-8-9-33-25-17-27(39-11-10-38-5)23(29(32)37)16-22(25)26;1-7-35-19(14-28(34-35)30(2,3)4)13-20(36)12-18-8-9-21(15-24(18)31)39-26-10-11-33-25-17-27(38-6)23(16-22(25)26)29(37)32-5;1-30(2,3)28-12-18(17-34-28)11-20(35)13-19-5-6-21(14-24(19)31)39-26-7-8-33-25-16-27(38-10-9-37-4)23(29(32)36)15-22(25)26;1-17(2)37-27-15-25-22(14-23(27)29(32)36)26(8-9-33-25)38-21-7-6-19(24(31)13-21)12-20(35)10-18-11-28(34-16-18)30(3,4)5;1-29(2,3)27-13-18(34(5)33-27)12-19(35)11-17-7-8-20(14-23(17)30)38-25-9-10-32-24-16-26(37-6)22(15-21(24)25)28(36)31-4;1-29(2,3)27-11-17(16-33-27)10-19(34)12-18-6-7-20(13-23(18)30)37-25-8-9-32-24-15-26(36-5)22(14-21(24)25)28(35)31-4;1-34-26-13-24-20(12-21(26)27(29)33)25(6-7-30-24)35-19-5-4-17(22(28)11-19)10-18(32)8-15-9-23(31-14-15)16-2-3-16/h10-13,16-19,21H,6-9,14-15H2,1-5H3,(H,35,40);6-9,14-17H,10-13H2,1-5H3,(H2,32,37);8-11,14-17H,7,12-13H2,1-6H3,(H,32,37);5-8,12,14-16H,9-11,13,17H2,1-4H3,(H2,32,36);6-9,11,13-15,17H,10,12,16H2,1-5H3,(H2,32,36);7-10,13-16H,11-12H2,1-6H3,(H,31,36);6-9,11,13-15H,10,12,16H2,1-5H3,(H,31,35);4-7,9,11-13,16H,2-3,8,10,14H2,1H3,(H2,29,33).
What are the key properties of 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide?
4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide has a molecular weight of 4332.42 g/mol, XLogP of 46.84, 74 rotatable bonds, 8 hydrogen bond donors, and 54 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-[3-(3-tert-butyl-1-cyclopentylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-ethylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(3-tert-butyl-1-methylpyrazol-5-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-(2-methoxyethoxy)quinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-methoxy-N-methylquinoline-6-carboxamide;4-[4-[3-(5-tert-butyl-2H-pyrrol-3-yl)-2-oxopropyl]-3-chlorophenoxy]-7-propan-2-yloxyquinoline-6-carboxamide;4-[3-chloro-4-[3-(5-cyclopropyl-2H-pyrrol-3-yl)-2-oxopropyl]phenoxy]-7-methoxyquinoline-6-carboxamide is sourced from PubChem (CID 158279843), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).