7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline

C180H252ClF9N22O13 — CID 158932148

IUPAC7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline
SMILESCC(C)(C)C1CC(Oc2cc(C(F)(F)F)nc3c(C(F)(F)F)cccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2cccc3cnccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2ccnc3cc(C(F)(F)F)ccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2ccnc3cc(Cl)ccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2nc(-n3ccnc3)nc3ccccc23)CN1C(C)(C)C.COc1cc2nc(N3CCOCC3)nc(OC3CC(C(C)(C)C)N(C(C)(C)C)C3)c2cc1OC.COc1ccc2c(OC3CC(C(C)(C)C)N(C(C)(C)C)C3)cc(N)nc2c1.COc1ccc2c(OC3CC(C(C)(C)C)N(C(C)(C)C)C3)ccnc2c1
InChIInChI=1S/C26H40N4O4.C23H28F6N2O.C23H31N5O.C22H29F3N2O.C22H33N3O2.C22H32N2O2.C21H29ClN2O.C21H30N2O/c1-25(2,3)22-13-17(16-30(22)26(4,5)6)34-23-18-14-20(31-7)21(32-8)15-19(18)27-24(28-23)29-9-11-33-12-10-29;1-20(2,3)18-10-13(12-31(18)21(4,5)6)32-16-11-17(23(27,28)29)30-19-14(16)8-7-9-15(19)22(24,25)26;1-22(2,3)19-13-16(14-28(19)23(4,5)6)29-20-17-9-7-8-10-18(17)25-21(26-20)27-12-11-24-15-27;1-20(2,3)19-12-15(13-27(19)21(4,5)6)28-18-9-10-26-17-11-14(22(23,24)25)7-8-16(17)18;1-21(2,3)19-11-15(13-25(19)22(4,5)6)27-18-12-20(23)24-17-10-14(26-7)8-9-16(17)18;1-21(2,3)20-13-16(14-24(20)22(4,5)6)26-19-10-11-23-18-12-15(25-7)8-9-17(18)19;1-20(2,3)19-12-15(13-24(19)21(4,5)6)25-18-9-10-23-17-11-14(22)7-8-16(17)18;1-20(2,3)19-12-16(14-23(19)21(4,5)6)24-18-9-7-8-15-13-22-11-10-17(15)18/h14-15,17,22H,9-13,16H2,1-8H3;7-9,11,13,18H,10,12H2,1-6H3;7-12,15-16,19H,13-14H2,1-6H3;7-11,15,19H,12-13H2,1-6H3;8-10,12,15,19H,11,13H2,1-7H3,(H2,23,24);8-12,16,20H,13-14H2,1-7H3;7-11,15,19H,12-13H2,1-6H3;7-11,13,16,19H,12,14H2,1-6H3
InChIKeyJJEVZPSQCYQOMG-UHFFFAOYSA-N
MW3138.57 g/mol
LogP41.35
Rot. Bonds22

About 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline

7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline (PubChem CID 158932148) has the molecular formula C180H252ClF9N22O13 and a molecular weight of 3138.57 g/mol. Its IUPAC name is 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline.

Molecular Properties

Compound Name7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline
PubChem CID158932148
Molecular FormulaC180H252ClF9N22O13
Molecular Weight3138.57 g/mol
Exact Mass3135.93
IUPAC Name7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline
SMILESCC(C)(C)C1CC(Oc2cc(C(F)(F)F)nc3c(C(F)(F)F)cccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2cccc3cnccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2ccnc3cc(C(F)(F)F)ccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2ccnc3cc(Cl)ccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2nc(-n3ccnc3)nc3ccccc23)CN1C(C)(C)C.COc1cc2nc(N3CCOCC3)nc(OC3CC(C(C)(C)C)N(C(C)(C)C)C3)c2cc1OC.COc1ccc2c(OC3CC(C(C)(C)C)N(C(C)(C)C)C3)cc(N)nc2c1.COc1ccc2c(OC3CC(C(C)(C)C)N(C(C)(C)C)C3)ccnc2c1
InChIInChI=1S/C26H40N4O4.C23H28F6N2O.C23H31N5O.C22H29F3N2O.C22H33N3O2.C22H32N2O2.C21H29ClN2O.C21H30N2O/c1-25(2,3)22-13-17(16-30(22)26(4,5)6)34-23-18-14-20(31-7)21(32-8)15-19(18)27-24(28-23)29-9-11-33-12-10-29;1-20(2,3)18-10-13(12-31(18)21(4,5)6)32-16-11-17(23(27,28)29)30-19-14(16)8-7-9-15(19)22(24,25)26;1-22(2,3)19-13-16(14-28(19)23(4,5)6)29-20-17-9-7-8-10-18(17)25-21(26-20)27-12-11-24-15-27;1-20(2,3)19-12-15(13-27(19)21(4,5)6)28-18-9-10-26-17-11-14(22(23,24)25)7-8-16(17)18;1-21(2,3)19-11-15(13-25(19)22(4,5)6)27-18-12-20(23)24-17-10-14(26-7)8-9-16(17)18;1-21(2,3)20-13-16(14-24(20)22(4,5)6)26-19-10-11-23-18-12-15(25-7)8-9-17(18)19;1-20(2,3)19-12-15(13-24(19)21(4,5)6)25-18-9-10-23-17-11-14(22)7-8-16(17)18;1-20(2,3)19-12-16(14-23(19)21(4,5)6)24-18-9-7-8-15-13-22-11-10-17(15)18/h14-15,17,22H,9-13,16H2,1-8H3;7-9,11,13,18H,10,12H2,1-6H3;7-12,15-16,19H,13-14H2,1-6H3;7-11,15,19H,12-13H2,1-6H3;8-10,12,15,19H,11,13H2,1-7H3,(H2,23,24);8-12,16,20H,13-14H2,1-7H3;7-11,15,19H,12-13H2,1-6H3;7-11,13,16,19H,12,14H2,1-6H3
InChIKeyJJEVZPSQCYQOMG-UHFFFAOYSA-N
XLogP41.35
TPSA321.89 Ų
H-Bond Donors1
H-Bond Acceptors35
Rotatable Bonds22
Heavy Atoms225
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003138.57
LogP ≤ 541.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1035

Analyze 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline with MolForge

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Related Compounds

1-[4-(2-Amino-7-methoxyquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-[4-(7-chloroquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-[4-(2-imidazol-1-ylquinazolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-(4-isoquinolin-1-yloxy-1-methylpyrrolidin-2-yl)ethanone;1-(4-isoquinolin-4-yloxy-1-methylpyrrolidin-2-yl)ethanone;1-(4-isoquinolin-5-yloxy-1-methylpyrrolidin-2-yl)ethanone;methane;1-[4-(7-methoxyquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-[1-methyl-4-(7-methylquinolin-4-yl)oxypyrrolidin-2-yl]ethanone;1-[1-methyl-4-[2-methyl-8-(trifluoromethyl)quinolin-4-yl]oxypyrrolidin-2-yl]ethanone;1-(1-methyl-4-quinolin-4-yloxypyrrolidin-2-yl)ethanone
CID 157109969
1-[4-[2,8-bis(trifluoromethyl)quinolin-4-yl]oxy-1-methylpyrrolidin-2-yl]ethanone;1-[4-(6,7-dimethoxy-2-morpholin-4-ylquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-[4-(2-imidazol-1-ylquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-[1-methyl-4-(2-phenylquinazolin-4-yl)oxypyrrolidin-2-yl]ethanone;1-[1-methyl-4-[2-(3H-pyrrol-5-yl)quinolin-4-yl]oxypyrrolidin-2-yl]ethanone
CID 158192662
Tert-butylbenzene;4-tert-butyl-2,8-bis(trifluoromethyl)quinoline;2-tert-butyl-5-chloropyridine;4-tert-butyl-7-chloroquinoline;4-(4-tert-butyl-6,7-dimethoxyquinazolin-2-yl)morpholine;4-tert-butyl-2-imidazol-1-ylquinazoline;1-tert-butylisoquinoline;4-tert-butylisoquinoline;5-tert-butylisoquinoline;4-tert-butyl-7-methoxyquinolin-2-amine;4-tert-butyl-7-methoxyquinoline;1-tert-butylnaphthalene;2-tert-butylnaphthalene;4-tert-butylquinazoline;4-tert-butylquinoline;4-tert-butyl-7-(trifluoromethyl)quinoline
CID 159611268
1-[4-(2-Amino-7-methoxyquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-[4-(7-chloroquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-(4-isoquinolin-1-yloxy-1-methylpyrrolidin-2-yl)ethanone;1-(4-isoquinolin-4-yloxy-1-methylpyrrolidin-2-yl)ethanone;1-(4-isoquinolin-5-yloxy-1-methylpyrrolidin-2-yl)ethanone;1-[4-(7-methoxyquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-(1-methyl-4-quinolin-4-yloxypyrrolidin-2-yl)ethanone;1-[1-methyl-4-[7-(trifluoromethyl)quinolin-4-yl]oxypyrrolidin-2-yl]ethanone
CID 159748724
1-[4-(2-Amino-7-methoxyquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-[4-[2,8-bis(trifluoromethyl)quinolin-4-yl]oxy-1-methylpyrrolidin-2-yl]ethanone;1-[4-(7-chloroquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-[4-(2-imidazol-1-ylquinazolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-(4-isoquinolin-1-yloxy-1-methylpyrrolidin-2-yl)ethanone;1-(4-isoquinolin-4-yloxy-1-methylpyrrolidin-2-yl)ethanone;1-(4-isoquinolin-5-yloxy-1-methylpyrrolidin-2-yl)ethanone;1-[4-(7-methoxyquinolin-4-yl)oxy-1-methylpyrrolidin-2-yl]ethanone;1-(1-methyl-4-quinolin-4-yloxypyrrolidin-2-yl)ethanone;1-[1-methyl-4-[7-(trifluoromethyl)quinolin-4-yl]oxypyrrolidin-2-yl]ethanone
CID 160126313
7-Chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethyl-2-piperidin-1-ylquinazoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methylquinolin-2-amine;bis(4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methylquinoline);4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-pyrrol-1-ylquinazoline
CID 160773205
7-Chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;1-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline
CID 162240607
N-benzyl-2-(4,4-difluoropiperidin-1-yl)-6-methoxy-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-phenyl-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-pyridin-2-yl-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-pyridin-3-yl-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine;2-(4,4-difluoropiperidin-1-yl)-6-methoxy-N-pyridin-4-yl-7-(3-pyrrolidin-1-ylpropoxy)quinazolin-4-amine
CID 163601579
[(2S)-1-[2-chloro-7-(trifluoromethyl)quinazolin-4-yl]pyrrolidin-2-yl]methanol;2,4-dichloro-7-(trifluoromethyl)quinazoline;[(2S)-1-[2-[[1-(3-methoxy-4,5-dimethylphenyl)imidazol-4-yl]amino]-7-(trifluoromethyl)quinazolin-4-yl]pyrrolidin-2-yl]methanol;[(2S)-pyrrolidin-2-yl]methanol;1-(3,4,5-trimethoxyphenyl)imidazol-4-amine
CID 167590701
N-(3-chloro-4-fluorophenyl)-7-methoxy-6-[2-(3-methylimidazol-3-ium-1-yl)ethoxy]quinazolin-4-amine;N-(3-chloro-4-fluorophenyl)-7-methoxy-6-[2-[(1-methylpyridin-1-ium-3-yl)amino]ethoxy]quinazolin-4-amine;N-(3-chloro-4-fluorophenyl)-7-methoxy-6-[2-[(1-methylpyridin-1-ium-4-yl)amino]ethoxy]quinazolin-4-amine;N-(4-fluoro-3-methylphenyl)-7-methoxy-6-[2-[(1-methylpyridin-1-ium-2-yl)amino]ethoxy]quinazolin-4-amine
CID 157995253
4-[6-chloro-3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)imidazo[1,2-a]pyridin-2-yl]-2-methoxyphenol;4-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)imidazo[1,2-a]pyrazin-2-yl]-2-methoxyphenol;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2,6-dimethylphenyl)imidazo[1,2-a]pyrimidin-3-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(2-fluoro-3-pyridinyl)imidazo[1,2-a]pyrazin-3-amine;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-fluoro-2-pyridinyl)imidazo[1,2-a]pyrazin-3-amine
CID 158536713
2-(2-chloro-6-fluorophenyl)-N-(2,3-dihydro-1,4-benzodioxin-6-yl)-5-methoxyimidazo[1,2-a]pyrimidin-3-amine;4-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-5-methoxyimidazo[1,2-a]pyrimidin-2-yl]-3,5-dimethylphenol;4-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-7-methylimidazo[1,2-a]pyridin-2-yl]-3-methoxyphenol;4-[3-(2,3-dihydro-1,4-benzodioxin-6-ylamino)-8-methylimidazo[1,2-a]pyridin-2-yl]-3-methoxyphenol;N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-(3-fluoro-2-pyridinyl)-7-methylimidazo[1,2-a]pyridin-3-amine
CID 159228668

Frequently Asked Questions

What is the IUPAC name of 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline?
The IUPAC name of 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline (CID 158932148) is 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline.
What is the SMILES notation for 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline?
The canonical SMILES for 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline is CC(C)(C)C1CC(Oc2cc(C(F)(F)F)nc3c(C(F)(F)F)cccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2cccc3cnccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2ccnc3cc(C(F)(F)F)ccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2ccnc3cc(Cl)ccc23)CN1C(C)(C)C.CC(C)(C)C1CC(Oc2nc(-n3ccnc3)nc3ccccc23)CN1C(C)(C)C.COc1cc2nc(N3CCOCC3)nc(OC3CC(C(C)(C)C)N(C(C)(C)C)C3)c2cc1OC.COc1ccc2c(OC3CC(C(C)(C)C)N(C(C)(C)C)C3)cc(N)nc2c1.COc1ccc2c(OC3CC(C(C)(C)C)N(C(C)(C)C)C3)ccnc2c1.
What is the InChIKey of 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline?
The InChIKey is JJEVZPSQCYQOMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H40N4O4.C23H28F6N2O.C23H31N5O.C22H29F3N2O.C22H33N3O2.C22H32N2O2.C21H29ClN2O.C21H30N2O/c1-25(2,3)22-13-17(16-30(22)26(4,5)6)34-23-18-14-20(31-7)21(32-8)15-19(18)27-24(28-23)29-9-11-33-12-10-29;1-20(2,3)18-10-13(12-31(18)21(4,5)6)32-16-11-17(23(27,28)29)30-19-14(16)8-7-9-15(19)22(24,25)26;1-22(2,3)19-13-16(14-28(19)23(4,5)6)29-20-17-9-7-8-10-18(17)25-21(26-20)27-12-11-24-15-27;1-20(2,3)19-12-15(13-27(19)21(4,5)6)28-18-9-10-26-17-11-14(22(23,24)25)7-8-16(17)18;1-21(2,3)19-11-15(13-25(19)22(4,5)6)27-18-12-20(23)24-17-10-14(26-7)8-9-16(17)18;1-21(2,3)20-13-16(14-24(20)22(4,5)6)26-19-10-11-23-18-12-15(25-7)8-9-17(18)19;1-20(2,3)19-12-15(13-24(19)21(4,5)6)25-18-9-10-23-17-11-14(22)7-8-16(17)18;1-20(2,3)19-12-16(14-23(19)21(4,5)6)24-18-9-7-8-15-13-22-11-10-17(15)18/h14-15,17,22H,9-13,16H2,1-8H3;7-9,11,13,18H,10,12H2,1-6H3;7-12,15-16,19H,13-14H2,1-6H3;7-11,15,19H,12-13H2,1-6H3;8-10,12,15,19H,11,13H2,1-7H3,(H2,23,24);8-12,16,20H,13-14H2,1-7H3;7-11,15,19H,12-13H2,1-6H3;7-11,13,16,19H,12,14H2,1-6H3.
What are the key properties of 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline?
7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline has a molecular weight of 3138.57 g/mol, XLogP of 41.35, 22 rotatable bonds, 1 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chloro-4-(1,5-ditert-butylpyrrolidin-3-yl)oxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2,8-bis(trifluoromethyl)quinoline;4-[4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-6,7-dimethoxyquinazolin-2-yl]morpholine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-2-imidazol-1-ylquinazoline;5-(1,5-ditert-butylpyrrolidin-3-yl)oxyisoquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinolin-2-amine;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-methoxyquinoline;4-(1,5-ditert-butylpyrrolidin-3-yl)oxy-7-(trifluoromethyl)quinoline is sourced from PubChem (CID 158932148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).