5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide

C269H330N52O17 — CID 160725743

IUPAC5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide
SMILESCCCCC(=O)CN1C(=O)N(c2cnc(C#N)nc2)CC12CCC(c1ccccc1)(N(C)C)CC2.CCN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cnc(C#N)nc1)C(=O)N2CC1(C#N)CCC1.CCN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cnc(C#N)nc1OC)C(=O)N2CC1CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccc(C#N)cc1)C(=O)N2CC1(O)CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccc(C#N)nc1)C(=O)N2CC1(C#N)CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cccc(C#N)c1)C(=O)N2CC1(O)CCC1.CNC1(c2ccccc2)CCC2(CC1)CN(c1ccccc1)C(=O)N2CC(=O)N(C)C.CNC1(c2ccccc2)CCC2(CC1)CN(c1cnc(C#N)nc1)C(=O)N2CC1(C#N)CCC1.COCCN1C(=O)N(c2ccccc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COCCN1C(=O)N(c2cnc(C#N)cc2C)CC12CCC(c1ccccc1)(N(C)C)CC2
InChIInChI=1S/C28H33N7O.C28H36N6O2.C28H32N6O.2C28H34N4O2.C27H34N6O2.C26H29N7O.C26H33N5O2.C25H32N4O2.C25H33N3O2/c1-3-33(2)28(22-8-5-4-6-9-22)14-12-27(13-15-28)21-34(23-17-31-24(16-29)32-18-23)25(36)35(27)20-26(19-30)10-7-11-26;1-4-32(2)28(22-11-6-5-7-12-22)15-13-27(14-16-28)20-33(26(35)34(27)19-21-9-8-10-21)23-18-30-24(17-29)31-25(23)36-3;1-32(2)28(22-7-4-3-5-8-22)15-13-27(14-16-28)21-33(24-10-9-23(17-29)31-18-24)25(35)34(27)20-26(19-30)11-6-12-26;1-30(2)28(23-9-4-3-5-10-23)16-14-26(15-17-28)20-31(24-11-6-8-22(18-24)19-29)25(33)32(26)21-27(34)12-7-13-27;1-30(2)28(23-7-4-3-5-8-23)17-15-26(16-18-28)20-31(24-11-9-22(19-29)10-12-24)25(33)32(26)21-27(34)13-6-14-27;1-4-5-11-23(34)19-33-25(35)32(22-17-29-24(16-28)30-18-22)20-26(33)12-14-27(15-13-26,31(2)3)21-9-7-6-8-10-21;1-29-26(20-6-3-2-4-7-20)12-10-25(11-13-26)19-32(21-15-30-22(14-27)31-16-21)23(34)33(25)18-24(17-28)8-5-9-24;1-20-16-22(17-27)28-18-23(20)30-19-25(31(24(30)32)14-15-33-4)10-12-26(13-11-25,29(2)3)21-8-6-5-7-9-21;1-26-25(20-10-6-4-7-11-20)16-14-24(15-17-25)19-28(21-12-8-5-9-13-21)23(31)29(24)18-22(30)27(2)3;1-26(2)25(21-10-6-4-7-11-21)16-14-24(15-17-25)20-27(22-12-8-5-9-13-22)23(29)28(24)18-19-30-3/h4-6,8-9,17-18H,3,7,10-15,20-21H2,1-2H3;5-7,11-12,18,21H,4,8-10,13-16,19-20H2,1-3H3;3-5,7-10,18H,6,11-16,20-21H2,1-2H3;3-6,8-11,18,34H,7,12-17,20-21H2,1-2H3;3-5,7-12,34H,6,13-18,20-21H2,1-2H3;6-10,17-18H,4-5,11-15,19-20H2,1-3H3;2-4,6-7,15-16,29H,5,8-13,18-19H2,1H3;5-9,16,18H,10-15,19H2,1-4H3;4-13,26H,14-19H2,1-3H3;4-13H,14-20H2,1-3H3
InChIKeyRTRLPDVCSWAWDZ-UHFFFAOYSA-N
MW4563.95 g/mol
LogP42.17
Rot. Bonds58

About 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide

5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide (PubChem CID 160725743) has the molecular formula C269H330N52O17 and a molecular weight of 4563.95 g/mol. Its IUPAC name is 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide.

Molecular Properties

Compound Name5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide
PubChem CID160725743
Molecular FormulaC269H330N52O17
Molecular Weight4563.95 g/mol
Exact Mass4560.66
IUPAC Name5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide
SMILESCCCCC(=O)CN1C(=O)N(c2cnc(C#N)nc2)CC12CCC(c1ccccc1)(N(C)C)CC2.CCN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cnc(C#N)nc1)C(=O)N2CC1(C#N)CCC1.CCN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cnc(C#N)nc1OC)C(=O)N2CC1CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccc(C#N)cc1)C(=O)N2CC1(O)CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccc(C#N)nc1)C(=O)N2CC1(C#N)CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cccc(C#N)c1)C(=O)N2CC1(O)CCC1.CNC1(c2ccccc2)CCC2(CC1)CN(c1ccccc1)C(=O)N2CC(=O)N(C)C.CNC1(c2ccccc2)CCC2(CC1)CN(c1cnc(C#N)nc1)C(=O)N2CC1(C#N)CCC1.COCCN1C(=O)N(c2ccccc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COCCN1C(=O)N(c2cnc(C#N)cc2C)CC12CCC(c1ccccc1)(N(C)C)CC2
InChIInChI=1S/C28H33N7O.C28H36N6O2.C28H32N6O.2C28H34N4O2.C27H34N6O2.C26H29N7O.C26H33N5O2.C25H32N4O2.C25H33N3O2/c1-3-33(2)28(22-8-5-4-6-9-22)14-12-27(13-15-28)21-34(23-17-31-24(16-29)32-18-23)25(36)35(27)20-26(19-30)10-7-11-26;1-4-32(2)28(22-11-6-5-7-12-22)15-13-27(14-16-28)20-33(26(35)34(27)19-21-9-8-10-21)23-18-30-24(17-29)31-25(23)36-3;1-32(2)28(22-7-4-3-5-8-22)15-13-27(14-16-28)21-33(24-10-9-23(17-29)31-18-24)25(35)34(27)20-26(19-30)11-6-12-26;1-30(2)28(23-9-4-3-5-10-23)16-14-26(15-17-28)20-31(24-11-6-8-22(18-24)19-29)25(33)32(26)21-27(34)12-7-13-27;1-30(2)28(23-7-4-3-5-8-23)17-15-26(16-18-28)20-31(24-11-9-22(19-29)10-12-24)25(33)32(26)21-27(34)13-6-14-27;1-4-5-11-23(34)19-33-25(35)32(22-17-29-24(16-28)30-18-22)20-26(33)12-14-27(15-13-26,31(2)3)21-9-7-6-8-10-21;1-29-26(20-6-3-2-4-7-20)12-10-25(11-13-26)19-32(21-15-30-22(14-27)31-16-21)23(34)33(25)18-24(17-28)8-5-9-24;1-20-16-22(17-27)28-18-23(20)30-19-25(31(24(30)32)14-15-33-4)10-12-26(13-11-25,29(2)3)21-8-6-5-7-9-21;1-26-25(20-10-6-4-7-11-20)16-14-24(15-17-25)19-28(21-12-8-5-9-13-21)23(31)29(24)18-22(30)27(2)3;1-26(2)25(21-10-6-4-7-11-21)16-14-24(15-17-25)20-27(22-12-8-5-9-13-22)23(29)28(24)18-19-30-3/h4-6,8-9,17-18H,3,7,10-15,20-21H2,1-2H3;5-7,11-12,18,21H,4,8-10,13-16,19-20H2,1-3H3;3-5,7-10,18H,6,11-16,20-21H2,1-2H3;3-6,8-11,18,34H,7,12-17,20-21H2,1-2H3;3-5,7-12,34H,6,13-18,20-21H2,1-2H3;6-10,17-18H,4-5,11-15,19-20H2,1-3H3;2-4,6-7,15-16,29H,5,8-13,18-19H2,1H3;5-9,16,18H,10-15,19H2,1-4H3;4-13,26H,14-19H2,1-3H3;4-13H,14-20H2,1-3H3
InChIKeyRTRLPDVCSWAWDZ-UHFFFAOYSA-N
XLogP42.17
TPSA781.60 Ų
H-Bond Donors4
H-Bond Acceptors48
Rotatable Bonds58
Heavy Atoms338
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004563.95
LogP ≤ 542.17
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 1048

Analyze 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide with MolForge

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What is the IUPAC name of 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide?
The IUPAC name of 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide (CID 160725743) is 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide.
What is the SMILES notation for 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide?
The canonical SMILES for 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide is CCCCC(=O)CN1C(=O)N(c2cnc(C#N)nc2)CC12CCC(c1ccccc1)(N(C)C)CC2.CCN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cnc(C#N)nc1)C(=O)N2CC1(C#N)CCC1.CCN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cnc(C#N)nc1OC)C(=O)N2CC1CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccc(C#N)cc1)C(=O)N2CC1(O)CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccc(C#N)nc1)C(=O)N2CC1(C#N)CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cccc(C#N)c1)C(=O)N2CC1(O)CCC1.CNC1(c2ccccc2)CCC2(CC1)CN(c1ccccc1)C(=O)N2CC(=O)N(C)C.CNC1(c2ccccc2)CCC2(CC1)CN(c1cnc(C#N)nc1)C(=O)N2CC1(C#N)CCC1.COCCN1C(=O)N(c2ccccc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COCCN1C(=O)N(c2cnc(C#N)cc2C)CC12CCC(c1ccccc1)(N(C)C)CC2.
What is the InChIKey of 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide?
The InChIKey is RTRLPDVCSWAWDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H33N7O.C28H36N6O2.C28H32N6O.2C28H34N4O2.C27H34N6O2.C26H29N7O.C26H33N5O2.C25H32N4O2.C25H33N3O2/c1-3-33(2)28(22-8-5-4-6-9-22)14-12-27(13-15-28)21-34(23-17-31-24(16-29)32-18-23)25(36)35(27)20-26(19-30)10-7-11-26;1-4-32(2)28(22-11-6-5-7-12-22)15-13-27(14-16-28)20-33(26(35)34(27)19-21-9-8-10-21)23-18-30-24(17-29)31-25(23)36-3;1-32(2)28(22-7-4-3-5-8-22)15-13-27(14-16-28)21-33(24-10-9-23(17-29)31-18-24)25(35)34(27)20-26(19-30)11-6-12-26;1-30(2)28(23-9-4-3-5-10-23)16-14-26(15-17-28)20-31(24-11-6-8-22(18-24)19-29)25(33)32(26)21-27(34)12-7-13-27;1-30(2)28(23-7-4-3-5-8-23)17-15-26(16-18-28)20-31(24-11-9-22(19-29)10-12-24)25(33)32(26)21-27(34)13-6-14-27;1-4-5-11-23(34)19-33-25(35)32(22-17-29-24(16-28)30-18-22)20-26(33)12-14-27(15-13-26,31(2)3)21-9-7-6-8-10-21;1-29-26(20-6-3-2-4-7-20)12-10-25(11-13-26)19-32(21-15-30-22(14-27)31-16-21)23(34)33(25)18-24(17-28)8-5-9-24;1-20-16-22(17-27)28-18-23(20)30-19-25(31(24(30)32)14-15-33-4)10-12-26(13-11-25,29(2)3)21-8-6-5-7-9-21;1-26-25(20-10-6-4-7-11-20)16-14-24(15-17-25)19-28(21-12-8-5-9-13-21)23(31)29(24)18-22(30)27(2)3;1-26(2)25(21-10-6-4-7-11-21)16-14-24(15-17-25)20-27(22-12-8-5-9-13-22)23(29)28(24)18-19-30-3/h4-6,8-9,17-18H,3,7,10-15,20-21H2,1-2H3;5-7,11-12,18,21H,4,8-10,13-16,19-20H2,1-3H3;3-5,7-10,18H,6,11-16,20-21H2,1-2H3;3-6,8-11,18,34H,7,12-17,20-21H2,1-2H3;3-5,7-12,34H,6,13-18,20-21H2,1-2H3;6-10,17-18H,4-5,11-15,19-20H2,1-3H3;2-4,6-7,15-16,29H,5,8-13,18-19H2,1H3;5-9,16,18H,10-15,19H2,1-4H3;4-13,26H,14-19H2,1-3H3;4-13H,14-20H2,1-3H3.
What are the key properties of 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide?
5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide has a molecular weight of 4563.95 g/mol, XLogP of 42.17, 58 rotatable bonds, 4 hydrogen bond donors, and 48 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[(1-cyanocyclobutyl)methyl]-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyridine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;5-[1-(cyclobutylmethyl)-8-[ethyl(methyl)amino]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methoxypyrimidine-2-carbonitrile;3-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;4-[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzonitrile;8-(dimethylamino)-1-(2-methoxyethyl)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;5-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]-4-methylpyridine-2-carbonitrile;5-[8-(dimethylamino)-2-oxo-1-(2-oxohexyl)-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide is sourced from PubChem (CID 160725743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).