1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one

C243H293F21N46O17S3 — CID 160602082

IUPAC1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one
SMILESCCC1(c2cccc(F)c2)CCC2(CC1)CN(c1ccc(S(C)(=O)=O)cn1)C(=O)N2CC1CC1.CN(C)C1(c2cccc(F)c2)CCC2(CC1)CN(c1ccc(S(C)(=O)=O)cn1)C(=O)N2CC1CC1.CN(C)C1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2.CN(C)C1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2CC1CC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cccc3c1CC(=O)N3)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1nnc(C(F)(F)F)s1)C(=O)N2.CN(CCO)C1=Nc2cc(N3CC4(CCC(c5ccccc5)(N(C)C)CC4)NC3=O)ccc2C1.CNC1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2CC1CC1.CNC1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2CC1CCC1.Cc1cc(N2CC3(CCC(c4ccccc4)(N(C)C)CC3)NC2=O)cnc1N1CCOCC1
InChIInChI=1S/C27H35N5O2.C26H33FN4O3S.C26H32FN3O3S.C26H35N5O2.2C25H29F4N5O.C24H27F4N5O.C24H28N4O2.C21H23F4N5O.C19H22F3N5OS/c1-30(2)27(21-7-5-4-6-8-21)13-11-26(12-14-27)19-32(25(34)29-26)22-10-9-20-17-24(28-23(20)18-22)31(3)15-16-33;1-29(2)26(20-5-4-6-21(27)15-20)13-11-25(12-14-26)18-30(24(32)31(25)17-19-7-8-19)23-10-9-22(16-28-23)35(3,33)34;1-3-25(20-5-4-6-21(27)15-20)11-13-26(14-12-25)18-29(24(31)30(26)17-19-7-8-19)23-10-9-22(16-28-23)34(2,32)33;1-20-17-22(18-27-23(20)30-13-15-33-16-14-30)31-19-25(28-24(31)32)9-11-26(12-10-25,29(2)3)21-7-5-4-6-8-21;1-32(2)24(18-4-3-5-19(26)12-18)10-8-23(9-11-24)16-33(22(35)34(23)15-17-6-7-17)20-13-30-21(31-14-20)25(27,28)29;1-30-24(18-6-3-7-19(26)12-18)10-8-23(9-11-24)16-33(22(35)34(23)15-17-4-2-5-17)20-13-31-21(32-14-20)25(27,28)29;1-29-23(17-3-2-4-18(25)11-17)9-7-22(8-10-23)15-32(21(34)33(22)14-16-5-6-16)19-12-30-20(31-13-19)24(26,27)28;1-27(2)24(17-7-4-3-5-8-17)13-11-23(12-14-24)16-28(22(30)26-23)20-10-6-9-19-18(20)15-21(29)25-19;1-29(2)20(14-4-3-5-15(22)10-14)8-6-19(7-9-20)13-30(18(31)28-19)16-11-26-17(27-12-16)21(23,24)25;1-26(2)18(13-6-4-3-5-7-13)10-8-17(9-11-18)12-27(15(28)23-17)16-25-24-14(29-16)19(20,21)22/h4-10,18,33H,11-17,19H2,1-3H3,(H,29,34);4-6,9-10,15-16,19H,7-8,11-14,17-18H2,1-3H3;4-6,9-10,15-16,19H,3,7-8,11-14,17-18H2,1-2H3;4-8,17-18H,9-16,19H2,1-3H3,(H,28,32);3-5,12-14,17H,6-11,15-16H2,1-2H3;3,6-7,12-14,17,30H,2,4-5,8-11,15-16H2,1H3;2-4,11-13,16,29H,5-10,14-15H2,1H3;3-10H,11-16H2,1-2H3,(H,25,29)(H,26,30);3-5,10-12H,6-9,13H2,1-2H3,(H,28,31);3-7H,8-12H2,1-2H3,(H,23,28)
InChIKeyREKGEANXBROBQV-UHFFFAOYSA-N
MW4625.48 g/mol
LogP42.15
Rot. Bonds45

About 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one

1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one (PubChem CID 160602082) has the molecular formula C243H293F21N46O17S3 and a molecular weight of 4625.48 g/mol. Its IUPAC name is 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one
PubChem CID160602082
Molecular FormulaC243H293F21N46O17S3
Molecular Weight4625.48 g/mol
Exact Mass4622.23
IUPAC Name1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one
SMILESCCC1(c2cccc(F)c2)CCC2(CC1)CN(c1ccc(S(C)(=O)=O)cn1)C(=O)N2CC1CC1.CN(C)C1(c2cccc(F)c2)CCC2(CC1)CN(c1ccc(S(C)(=O)=O)cn1)C(=O)N2CC1CC1.CN(C)C1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2.CN(C)C1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2CC1CC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cccc3c1CC(=O)N3)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1nnc(C(F)(F)F)s1)C(=O)N2.CN(CCO)C1=Nc2cc(N3CC4(CCC(c5ccccc5)(N(C)C)CC4)NC3=O)ccc2C1.CNC1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2CC1CC1.CNC1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2CC1CCC1.Cc1cc(N2CC3(CCC(c4ccccc4)(N(C)C)CC3)NC2=O)cnc1N1CCOCC1
InChIInChI=1S/C27H35N5O2.C26H33FN4O3S.C26H32FN3O3S.C26H35N5O2.2C25H29F4N5O.C24H27F4N5O.C24H28N4O2.C21H23F4N5O.C19H22F3N5OS/c1-30(2)27(21-7-5-4-6-8-21)13-11-26(12-14-27)19-32(25(34)29-26)22-10-9-20-17-24(28-23(20)18-22)31(3)15-16-33;1-29(2)26(20-5-4-6-21(27)15-20)13-11-25(12-14-26)18-30(24(32)31(25)17-19-7-8-19)23-10-9-22(16-28-23)35(3,33)34;1-3-25(20-5-4-6-21(27)15-20)11-13-26(14-12-25)18-29(24(31)30(26)17-19-7-8-19)23-10-9-22(16-28-23)34(2,32)33;1-20-17-22(18-27-23(20)30-13-15-33-16-14-30)31-19-25(28-24(31)32)9-11-26(12-10-25,29(2)3)21-7-5-4-6-8-21;1-32(2)24(18-4-3-5-19(26)12-18)10-8-23(9-11-24)16-33(22(35)34(23)15-17-6-7-17)20-13-30-21(31-14-20)25(27,28)29;1-30-24(18-6-3-7-19(26)12-18)10-8-23(9-11-24)16-33(22(35)34(23)15-17-4-2-5-17)20-13-31-21(32-14-20)25(27,28)29;1-29-23(17-3-2-4-18(25)11-17)9-7-22(8-10-23)15-32(21(34)33(22)14-16-5-6-16)19-12-30-20(31-13-19)24(26,27)28;1-27(2)24(17-7-4-3-5-8-17)13-11-23(12-14-24)16-28(22(30)26-23)20-10-6-9-19-18(20)15-21(29)25-19;1-29(2)20(14-4-3-5-15(22)10-14)8-6-19(7-9-20)13-30(18(31)28-19)16-11-26-17(27-12-16)21(23,24)25;1-26(2)18(13-6-4-3-5-7-13)10-8-17(9-11-18)12-27(15(28)23-17)16-25-24-14(29-16)19(20,21)22/h4-10,18,33H,11-17,19H2,1-3H3,(H,29,34);4-6,9-10,15-16,19H,7-8,11-14,17-18H2,1-3H3;4-6,9-10,15-16,19H,3,7-8,11-14,17-18H2,1-2H3;4-8,17-18H,9-16,19H2,1-3H3,(H,28,32);3-5,12-14,17H,6-11,15-16H2,1-2H3;3,6-7,12-14,17,30H,2,4-5,8-11,15-16H2,1H3;2-4,11-13,16,29H,5-10,14-15H2,1H3;3-10H,11-16H2,1-2H3,(H,25,29)(H,26,30);3-5,10-12H,6-9,13H2,1-2H3,(H,28,31);3-7H,8-12H2,1-2H3,(H,23,28)
InChIKeyREKGEANXBROBQV-UHFFFAOYSA-N
XLogP42.15
TPSA639.44 Ų
H-Bond Donors9
H-Bond Acceptors43
Rotatable Bonds45
Heavy Atoms330
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004625.48
LogP ≤ 542.15
H-Bond Donors ≤ 59
H-Bond Acceptors ≤ 1043

Analyze 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one with MolForge

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What is the IUPAC name of 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one?
The IUPAC name of 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one (CID 160602082) is 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one is CCC1(c2cccc(F)c2)CCC2(CC1)CN(c1ccc(S(C)(=O)=O)cn1)C(=O)N2CC1CC1.CN(C)C1(c2cccc(F)c2)CCC2(CC1)CN(c1ccc(S(C)(=O)=O)cn1)C(=O)N2CC1CC1.CN(C)C1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2.CN(C)C1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2CC1CC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cccc3c1CC(=O)N3)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1nnc(C(F)(F)F)s1)C(=O)N2.CN(CCO)C1=Nc2cc(N3CC4(CCC(c5ccccc5)(N(C)C)CC4)NC3=O)ccc2C1.CNC1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2CC1CC1.CNC1(c2cccc(F)c2)CCC2(CC1)CN(c1cnc(C(F)(F)F)nc1)C(=O)N2CC1CCC1.Cc1cc(N2CC3(CCC(c4ccccc4)(N(C)C)CC3)NC2=O)cnc1N1CCOCC1.
What is the InChIKey of 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one?
The InChIKey is REKGEANXBROBQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H35N5O2.C26H33FN4O3S.C26H32FN3O3S.C26H35N5O2.2C25H29F4N5O.C24H27F4N5O.C24H28N4O2.C21H23F4N5O.C19H22F3N5OS/c1-30(2)27(21-7-5-4-6-8-21)13-11-26(12-14-27)19-32(25(34)29-26)22-10-9-20-17-24(28-23(20)18-22)31(3)15-16-33;1-29(2)26(20-5-4-6-21(27)15-20)13-11-25(12-14-26)18-30(24(32)31(25)17-19-7-8-19)23-10-9-22(16-28-23)35(3,33)34;1-3-25(20-5-4-6-21(27)15-20)11-13-26(14-12-25)18-29(24(31)30(26)17-19-7-8-19)23-10-9-22(16-28-23)34(2,32)33;1-20-17-22(18-27-23(20)30-13-15-33-16-14-30)31-19-25(28-24(31)32)9-11-26(12-10-25,29(2)3)21-7-5-4-6-8-21;1-32(2)24(18-4-3-5-19(26)12-18)10-8-23(9-11-24)16-33(22(35)34(23)15-17-6-7-17)20-13-30-21(31-14-20)25(27,28)29;1-30-24(18-6-3-7-19(26)12-18)10-8-23(9-11-24)16-33(22(35)34(23)15-17-4-2-5-17)20-13-31-21(32-14-20)25(27,28)29;1-29-23(17-3-2-4-18(25)11-17)9-7-22(8-10-23)15-32(21(34)33(22)14-16-5-6-16)19-12-30-20(31-13-19)24(26,27)28;1-27(2)24(17-7-4-3-5-8-17)13-11-23(12-14-24)16-28(22(30)26-23)20-10-6-9-19-18(20)15-21(29)25-19;1-29(2)20(14-4-3-5-15(22)10-14)8-6-19(7-9-20)13-30(18(31)28-19)16-11-26-17(27-12-16)21(23,24)25;1-26(2)18(13-6-4-3-5-7-13)10-8-17(9-11-18)12-27(15(28)23-17)16-25-24-14(29-16)19(20,21)22/h4-10,18,33H,11-17,19H2,1-3H3,(H,29,34);4-6,9-10,15-16,19H,7-8,11-14,17-18H2,1-3H3;4-6,9-10,15-16,19H,3,7-8,11-14,17-18H2,1-2H3;4-8,17-18H,9-16,19H2,1-3H3,(H,28,32);3-5,12-14,17H,6-11,15-16H2,1-2H3;3,6-7,12-14,17,30H,2,4-5,8-11,15-16H2,1H3;2-4,11-13,16,29H,5-10,14-15H2,1H3;3-10H,11-16H2,1-2H3,(H,25,29)(H,26,30);3-5,10-12H,6-9,13H2,1-2H3,(H,28,31);3-7H,8-12H2,1-2H3,(H,23,28).
What are the key properties of 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one?
1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one has a molecular weight of 4625.48 g/mol, XLogP of 42.15, 45 rotatable bonds, 9 hydrogen bond donors, and 43 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclobutylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-ethyl-8-(3-fluorophenyl)-3-(5-methylsulfonyl-2-pyridinyl)-1,3-diazaspiro[4.5]decan-2-one;1-(cyclopropylmethyl)-8-(3-fluorophenyl)-8-(methylamino)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-(3-fluorophenyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]-3H-indol-6-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methyl-6-morpholin-4-yl-3-pyridinyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-oxo-1,3-dihydroindol-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]-1,3-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 160602082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).