5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide

C256H324N50O16S — CID 159927108

IUPAC5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide
SMILESCN(C)C(=O)CN1C(=O)N(c2ccccc2)CC12CCC(c1ccccc1)(N(C)C)CC2.CN(C)C(=O)CN1C(=O)N(c2ccnc(C#N)n2)CC12CCC(c1ccccc1)(N(C)C)CC2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cc(C#N)ncn1)C(=O)N2CC1CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccccc1)C(=O)N2CC1CCC1.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.COCCN1C(=O)N(c2ncc(C#N)cn2)CC12CCC(c1ccccc1)(N(C)C)CC2.CSc1cc(N2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCC3)C2=O)ncn1
InChIInChI=1S/C27H35N3O.C26H29N7O.C26H32N6O.C26H33N5O2.C26H35N5OS.C26H34N4O2.C25H31N7O2.C25H32N4O2.C25H33N3O2.C24H30N6O2/c1-28(2)27(23-12-5-3-6-13-23)18-16-26(17-19-27)21-29(24-14-7-4-8-15-24)25(31)30(26)20-22-10-9-11-22;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;1-30(2)26(21-9-4-3-5-10-21)13-11-25(12-14-26)18-31(23-15-22(16-27)28-19-29-23)24(33)32(25)17-20-7-6-8-20;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;1-29(2)26(21-10-5-4-6-11-21)14-12-25(13-15-26)18-30(22-16-23(33-3)28-19-27-22)24(32)31(25)17-20-8-7-9-20;1-27(2)23(31)19-30-24(32)29(22-13-9-6-10-14-22)20-25(30)15-17-26(18-16-25,28(3)4)21-11-7-5-8-12-21;1-29(2)22(33)17-32-23(34)31(21-10-15-27-20(16-26)28-21)18-24(32)11-13-25(14-12-24,30(3)4)19-8-6-5-7-9-19;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;1-28(2)24(20-7-5-4-6-8-20)11-9-23(10-12-24)18-29(22(31)30(23)13-14-32-3)21-26-16-19(15-25)17-27-21/h3-8,12-15,22H,9-11,16-21H2,1-2H3;2-4,6-7,15-16,29H,5,8-13,18-19H2,1H3;3-5,9-10,15,19-20H,6-8,11-14,17-18H2,1-2H3;5-9,16,18H,10-15,19H2,1-4H3;4-6,10-11,16,19-20H,7-9,12-15,17-18H2,1-3H3;5-14H,15-20H2,1-4H3;5-10,15H,11-14,17-18H2,1-4H3;4-13,26H,14-19H2,1-3H3;4-13H,14-20H2,1-3H3;4-8,16-17H,9-14,18H2,1-3H3
InChIKeyNZDVKLSUOMCDFT-UHFFFAOYSA-N
MW4389.81 g/mol
LogP39.33
Rot. Bonds54

About 5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;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-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide (PubChem CID 159927108) has the molecular formula C256H324N50O16S and a molecular weight of 4389.81 g/mol. Its IUPAC name is 5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;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-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide
PubChem CID159927108
Molecular FormulaC256H324N50O16S
Molecular Weight4389.81 g/mol
Exact Mass4386.58
IUPAC Name5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide
SMILESCN(C)C(=O)CN1C(=O)N(c2ccccc2)CC12CCC(c1ccccc1)(N(C)C)CC2.CN(C)C(=O)CN1C(=O)N(c2ccnc(C#N)n2)CC12CCC(c1ccccc1)(N(C)C)CC2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cc(C#N)ncn1)C(=O)N2CC1CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccccc1)C(=O)N2CC1CCC1.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.COCCN1C(=O)N(c2ncc(C#N)cn2)CC12CCC(c1ccccc1)(N(C)C)CC2.CSc1cc(N2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCC3)C2=O)ncn1
InChIInChI=1S/C27H35N3O.C26H29N7O.C26H32N6O.C26H33N5O2.C26H35N5OS.C26H34N4O2.C25H31N7O2.C25H32N4O2.C25H33N3O2.C24H30N6O2/c1-28(2)27(23-12-5-3-6-13-23)18-16-26(17-19-27)21-29(24-14-7-4-8-15-24)25(31)30(26)20-22-10-9-11-22;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;1-30(2)26(21-9-4-3-5-10-21)13-11-25(12-14-26)18-31(23-15-22(16-27)28-19-29-23)24(33)32(25)17-20-7-6-8-20;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;1-29(2)26(21-10-5-4-6-11-21)14-12-25(13-15-26)18-30(22-16-23(33-3)28-19-27-22)24(32)31(25)17-20-8-7-9-20;1-27(2)23(31)19-30-24(32)29(22-13-9-6-10-14-22)20-25(30)15-17-26(18-16-25,28(3)4)21-11-7-5-8-12-21;1-29(2)22(33)17-32-23(34)31(21-10-15-27-20(16-26)28-21)18-24(32)11-13-25(14-12-24,30(3)4)19-8-6-5-7-9-19;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;1-28(2)24(20-7-5-4-6-8-20)11-9-23(10-12-24)18-29(22(31)30(23)13-14-32-3)21-26-16-19(15-25)17-27-21/h3-8,12-15,22H,9-11,16-21H2,1-2H3;2-4,6-7,15-16,29H,5,8-13,18-19H2,1H3;3-5,9-10,15,19-20H,6-8,11-14,17-18H2,1-2H3;5-9,16,18H,10-15,19H2,1-4H3;4-6,10-11,16,19-20H,7-9,12-15,17-18H2,1-3H3;5-14H,15-20H2,1-4H3;5-10,15H,11-14,17-18H2,1-4H3;4-13,26H,14-19H2,1-3H3;4-13H,14-20H2,1-3H3;4-8,16-17H,9-14,18H2,1-3H3
InChIKeyNZDVKLSUOMCDFT-UHFFFAOYSA-N
XLogP39.33
TPSA658.63 Ų
H-Bond Donors2
H-Bond Acceptors44
Rotatable Bonds54
Heavy Atoms323
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5004389.81
LogP ≤ 539.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1044

Analyze 5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;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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Frequently Asked Questions

What is the IUPAC name of 5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;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-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide (CID 159927108) is 5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;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-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;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-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide is CN(C)C(=O)CN1C(=O)N(c2ccccc2)CC12CCC(c1ccccc1)(N(C)C)CC2.CN(C)C(=O)CN1C(=O)N(c2ccnc(C#N)n2)CC12CCC(c1ccccc1)(N(C)C)CC2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cc(C#N)ncn1)C(=O)N2CC1CCC1.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccccc1)C(=O)N2CC1CCC1.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.COCCN1C(=O)N(c2ncc(C#N)cn2)CC12CCC(c1ccccc1)(N(C)C)CC2.CSc1cc(N2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCC3)C2=O)ncn1.
What is the InChIKey of 5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;N,N-dimethyl-2-[8-(methylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide?
The InChIKey is NZDVKLSUOMCDFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H35N3O.C26H29N7O.C26H32N6O.C26H33N5O2.C26H35N5OS.C26H34N4O2.C25H31N7O2.C25H32N4O2.C25H33N3O2.C24H30N6O2/c1-28(2)27(23-12-5-3-6-13-23)18-16-26(17-19-27)21-29(24-14-7-4-8-15-24)25(31)30(26)20-22-10-9-11-22;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;1-30(2)26(21-9-4-3-5-10-21)13-11-25(12-14-26)18-31(23-15-22(16-27)28-19-29-23)24(33)32(25)17-20-7-6-8-20;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;1-29(2)26(21-10-5-4-6-11-21)14-12-25(13-15-26)18-30(22-16-23(33-3)28-19-27-22)24(32)31(25)17-20-8-7-9-20;1-27(2)23(31)19-30-24(32)29(22-13-9-6-10-14-22)20-25(30)15-17-26(18-16-25,28(3)4)21-11-7-5-8-12-21;1-29(2)22(33)17-32-23(34)31(21-10-15-27-20(16-26)28-21)18-24(32)11-13-25(14-12-24,30(3)4)19-8-6-5-7-9-19;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;1-28(2)24(20-7-5-4-6-8-20)11-9-23(10-12-24)18-29(22(31)30(23)13-14-32-3)21-26-16-19(15-25)17-27-21/h3-8,12-15,22H,9-11,16-21H2,1-2H3;2-4,6-7,15-16,29H,5,8-13,18-19H2,1H3;3-5,9-10,15,19-20H,6-8,11-14,17-18H2,1-2H3;5-9,16,18H,10-15,19H2,1-4H3;4-6,10-11,16,19-20H,7-9,12-15,17-18H2,1-3H3;5-14H,15-20H2,1-4H3;5-10,15H,11-14,17-18H2,1-4H3;4-13,26H,14-19H2,1-3H3;4-13H,14-20H2,1-3H3;4-8,16-17H,9-14,18H2,1-3H3.
What are the key properties of 5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;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-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;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 4389.81 g/mol, XLogP of 39.33, 54 rotatable bonds, 2 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[1-[(1-cyanocyclobutyl)methyl]-8-(methylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-2-carbonitrile;2-[3-(2-cyanopyrimidin-4-yl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3,8-diphenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclobutylmethyl)-8-(dimethylamino)-3-(6-methylsulfanylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;6-[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-4-carbonitrile;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;2-[8-(dimethylamino)-1-(2-methoxyethyl)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidine-5-carbonitrile;2-[8-(dimethylamino)-2-oxo-3,8-diphenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;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 159927108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).