3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one

C127H155F2N29O9 — CID 158943290

IUPAC3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one
SMILESCN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccc3nonc3c1)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccccc1OCC(N)=O)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cnccn1)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ncc(F)cn1)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ncncc1F)C(=O)N2.Cc1cnc(N2CC3(CCC(c4ccccc4)(N(C)C)CC3)NC2=O)cn1
InChIInChI=1S/C24H30N4O3.C22H25N5O2.C21H27N5O.2C20H24FN5O.C20H25N5O/c1-27(2)24(18-8-4-3-5-9-18)14-12-23(13-15-24)17-28(22(30)26-23)19-10-6-7-11-20(19)31-16-21(25)29;1-26(2)22(16-6-4-3-5-7-16)12-10-21(11-13-22)15-27(20(28)23-21)17-8-9-18-19(14-17)25-29-24-18;1-16-13-23-18(14-22-16)26-15-20(24-19(26)27)9-11-21(12-10-20,25(2)3)17-7-5-4-6-8-17;1-25(2)20(15-6-4-3-5-7-15)10-8-19(9-11-20)13-26(18(27)24-19)17-16(21)12-22-14-23-17;1-25(2)20(15-6-4-3-5-7-15)10-8-19(9-11-20)14-26(18(27)24-19)17-22-12-16(21)13-23-17;1-24(2)20(16-6-4-3-5-7-16)10-8-19(9-11-20)15-25(18(26)23-19)17-14-21-12-13-22-17/h3-11H,12-17H2,1-2H3,(H2,25,29)(H,26,30);3-9,14H,10-13,15H2,1-2H3,(H,23,28);4-8,13-14H,9-12,15H2,1-3H3,(H,24,27);3-7,12,14H,8-11,13H2,1-2H3,(H,24,27);3-7,12-13H,8-11,14H2,1-2H3,(H,24,27);3-7,12-14H,8-11,15H2,1-2H3,(H,23,26)
InChIKeyJKNANOJFDRQVQE-UHFFFAOYSA-N
MW2269.83 g/mol
LogP18.06
Rot. Bonds21

About 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one

3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one (PubChem CID 158943290) has the molecular formula C127H155F2N29O9 and a molecular weight of 2269.83 g/mol. Its IUPAC name is 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound Name3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one
PubChem CID158943290
Molecular FormulaC127H155F2N29O9
Molecular Weight2269.83 g/mol
Exact Mass2268.25
IUPAC Name3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one
SMILESCN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccc3nonc3c1)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccccc1OCC(N)=O)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cnccn1)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ncc(F)cn1)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ncncc1F)C(=O)N2.Cc1cnc(N2CC3(CCC(c4ccccc4)(N(C)C)CC3)NC2=O)cn1
InChIInChI=1S/C24H30N4O3.C22H25N5O2.C21H27N5O.2C20H24FN5O.C20H25N5O/c1-27(2)24(18-8-4-3-5-9-18)14-12-23(13-15-24)17-28(22(30)26-23)19-10-6-7-11-20(19)31-16-21(25)29;1-26(2)22(16-6-4-3-5-7-16)12-10-21(11-13-22)15-27(20(28)23-21)17-8-9-18-19(14-17)25-29-24-18;1-16-13-23-18(14-22-16)26-15-20(24-19(26)27)9-11-21(12-10-20,25(2)3)17-7-5-4-6-8-17;1-25(2)20(15-6-4-3-5-7-15)10-8-19(9-11-20)13-26(18(27)24-19)17-16(21)12-22-14-23-17;1-25(2)20(15-6-4-3-5-7-15)10-8-19(9-11-20)14-26(18(27)24-19)17-22-12-16(21)13-23-17;1-24(2)20(16-6-4-3-5-7-16)10-8-19(9-11-20)15-25(18(26)23-19)17-14-21-12-13-22-17/h3-11H,12-17H2,1-2H3,(H2,25,29)(H,26,30);3-9,14H,10-13,15H2,1-2H3,(H,23,28);4-8,13-14H,9-12,15H2,1-3H3,(H,24,27);3-7,12,14H,8-11,13H2,1-2H3,(H,24,27);3-7,12-13H,8-11,14H2,1-2H3,(H,24,27);3-7,12-14H,8-11,15H2,1-2H3,(H,23,26)
InChIKeyJKNANOJFDRQVQE-UHFFFAOYSA-N
XLogP18.06
TPSA407.84 Ų
H-Bond Donors7
H-Bond Acceptors25
Rotatable Bonds21
Heavy Atoms167
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002269.83
LogP ≤ 518.06
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1025

Analyze 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one with MolForge

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Related Compounds

2-(benzimidazol-1-yl)-7-[(4S)-4-[2-(benzimidazol-1-yl)-8-oxo-7H-purin-9-yl]-6-fluoro-3,4-dihydro-2H-chromen-8-yl]-9-[(4S)-5,6-difluoro-3,4-dihydro-2H-chromen-4-yl]purin-8-one
CID 143306727
3-(2,1,3-Benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[3-fluoro-5-(trifluoromethyl)-2-pyridinyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzamide;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-(5-pyridin-4-ylthiophen-2-yl)-1,3-diazaspiro[4.5]decan-2-one
CID 157207907
3-(2,1,3-Benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[3-fluoro-5-(trifluoromethyl)-2-pyridinyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[2-[2-hydroxyethyl(methyl)amino]pyrimidin-5-yl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]benzamide;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-(5-pyridin-4-ylthiophen-2-yl)-1,3-diazaspiro[4.5]decan-2-one
CID 160448807
N-[5-[[4-(3,4-dihydro-1H-[1,4]oxazino[4,3-a]indol-10-yl)-5-fluoropyrimidin-2-yl]amino]-2-[2-(dimethylamino)ethyl-methylamino]-4-methoxyphenyl]prop-2-enamide;N-[5-[[4-(3,4-dihydro-1H-[1,4]oxazino[4,3-a]indol-10-yl)pyrimidin-2-yl]amino]-2-[2-(dimethylamino)ethyl-methylamino]-4-ethoxyphenyl]prop-2-enamide;N-[5-[[4-(3,4-dihydro-1H-[1,4]oxazino[4,3-a]indol-10-yl)pyrimidin-2-yl]amino]-2-[2-(dimethylamino)ethyl-methylamino]-4-propan-2-yloxyphenyl]prop-2-enamide;N-[5-[[4-(3,4-dihydro-1H-[1,4]oxazino[4,3-a]indol-10-yl)pyrimidin-2-yl]amino]-4-methoxy-2-[methyl-[2-(methylamino)ethyl]amino]phenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-5-[[4-(8-fluoro-3,4-dihydro-1H-[1,4]oxazino[4,3-a]indol-10-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide
CID 157050207
4-[2-[2-amino-5-(difluoromethoxy)-N-methyl-4-[[4-(1-methylindol-3-yl)pyrimidin-2-yl]amino]anilino]ethyl]morpholin-3-one;4-[2-[5-(difluoromethoxy)-N-methyl-4-[[4-(1-methylindol-3-yl)pyrimidin-2-yl]amino]-2-nitroanilino]ethyl]morpholin-3-one
CID 157326269
8a-(4-fluorophenyl)-3-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-6-methyl-7,8-dihydro-1H-imidazo[1,5-c]pyrimidin-5-one;8a-(4-fluorophenyl)-3-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-1,6,7,8-tetrahydroimidazo[1,5-c]pyrimidin-5-one;4a-(4-fluorophenyl)-1-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-4,5,6,7-tetrahydro-3H-pyrimido[1,6-c]pyrimidin-8-one;1-[6-(4-fluorophenyl)-2-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-6-methyl-4,5-dihydropyrimidin-1-yl]ethanone;1-[5-(4-fluorophenyl)-2-[(E)-2-[3-methoxy-4-(4-methylimidazol-1-yl)phenyl]ethenyl]-5-methyl-4H-imidazol-1-yl]ethanone
CID 157774101
N-[4-(difluoromethoxy)-2-[2-(dimethylamino)ethyl-methylamino]-5-[[4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide;bis(N-[2-[2-(dimethylamino)ethyl-methylamino]-4-ethoxy-5-[[4-(7-fluoro-2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide);N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[4-(2-methyl-3-propan-2-ylbenzimidazol-5-yl)pyrimidin-2-yl]amino]phenyl]prop-2-enamide
CID 157931275
N-[[4-[6-(3,4-difluorophenyl)benzimidazol-1-yl]phenyl]methyl]acetamide;N-[[4-[6-(6-methoxy-3-pyridinyl)benzimidazol-1-yl]phenyl]methyl]acetamide;6-phenyl-1-[4-(piperidin-1-ylmethyl)phenyl]benzimidazole;1-[4-(piperidin-1-ylmethyl)phenyl]-6-pyridin-4-ylbenzimidazole;4-[4-(6-pyridin-4-ylbenzimidazol-1-yl)phenyl]morpholine
CID 158199388
9-(3,4-dihydro-2H-chromen-4-yl)-2-(6-isocyanobenzimidazol-1-yl)-7-(2-methoxyethyl)purin-8-one;9-(3,4-dihydro-2H-chromen-4-yl)-2-(6-isocyanobenzimidazol-1-yl)-7H-purin-8-one;2-(6-fluorobenzimidazol-1-yl)-9-(8-fluoro-3,4-dihydro-2H-chromen-4-yl)-7-methylpurin-8-one;2-(6-fluorobenzimidazol-1-yl)-9-(8-fluoro-3,4-dihydro-2H-chromen-4-yl)-7H-purin-8-one;9-(6-fluoro-3,4-dihydro-2H-chromen-4-yl)-2-(6-isocyanobenzimidazol-1-yl)-7-methylpurin-8-one;9-(6-fluoro-3,4-dihydro-2H-chromen-4-yl)-2-(6-isocyanobenzimidazol-1-yl)-7H-purin-8-one
CID 158617524
3-(2,1,3-Benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-8-phenyl-3-(5-pyridin-4-ylthiophen-2-yl)-1,3-diazaspiro[4.5]decan-2-one;methyl 2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetate
CID 158838941
N-[2-[2-(dimethylamino)ethyl-methylamino]-5-[[4-(2,5-dimethylbenzimidazol-1-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-5-[[5-fluoro-4-(6-isocyano-2-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;N-[2-[2-(dimethylamino)ethyl-methylamino]-5-[[4-(6-isocyano-2-methylbenzimidazol-1-yl)pyrimidin-2-yl]amino]-4-methoxyphenyl]prop-2-enamide;bis(N-[2-[2-(dimethylamino)ethyl-methylamino]-4-methoxy-5-[[4-(5-methoxy-2-methylbenzimidazol-1-yl)-5-methylpyrimidin-2-yl]amino]phenyl]prop-2-enamide)
CID 158846477
3-(2-Aminopyrimidin-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[2-(3,4-difluorophenyl)pyrimidin-5-yl]-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(2-morpholin-4-ylpyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;2-[5-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]pyrimidin-2-yl]benzonitrile;8-(dimethylamino)-8-phenyl-3-(5-pyridin-4-ylthiophen-2-yl)-1,3-diazaspiro[4.5]decan-2-one;methyl 2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetate
CID 159036525

Frequently Asked Questions

What is the IUPAC name of 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one?
The IUPAC name of 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one (CID 158943290) is 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one?
The canonical SMILES for 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one is CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccc3nonc3c1)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ccccc1OCC(N)=O)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1cnccn1)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ncc(F)cn1)C(=O)N2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(c1ncncc1F)C(=O)N2.Cc1cnc(N2CC3(CCC(c4ccccc4)(N(C)C)CC3)NC2=O)cn1.
What is the InChIKey of 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one?
The InChIKey is JKNANOJFDRQVQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H30N4O3.C22H25N5O2.C21H27N5O.2C20H24FN5O.C20H25N5O/c1-27(2)24(18-8-4-3-5-9-18)14-12-23(13-15-24)17-28(22(30)26-23)19-10-6-7-11-20(19)31-16-21(25)29;1-26(2)22(16-6-4-3-5-7-16)12-10-21(11-13-22)15-27(20(28)23-21)17-8-9-18-19(14-17)25-29-24-18;1-16-13-23-18(14-22-16)26-15-20(24-19(26)27)9-11-21(12-10-20,25(2)3)17-7-5-4-6-8-17;1-25(2)20(15-6-4-3-5-7-15)10-8-19(9-11-20)13-26(18(27)24-19)17-16(21)12-22-14-23-17;1-25(2)20(15-6-4-3-5-7-15)10-8-19(9-11-20)14-26(18(27)24-19)17-22-12-16(21)13-23-17;1-24(2)20(16-6-4-3-5-7-16)10-8-19(9-11-20)15-25(18(26)23-19)17-14-21-12-13-22-17/h3-11H,12-17H2,1-2H3,(H2,25,29)(H,26,30);3-9,14H,10-13,15H2,1-2H3,(H,23,28);4-8,13-14H,9-12,15H2,1-3H3,(H,24,27);3-7,12,14H,8-11,13H2,1-2H3,(H,24,27);3-7,12-13H,8-11,14H2,1-2H3,(H,24,27);3-7,12-14H,8-11,15H2,1-2H3,(H,23,26).
What are the key properties of 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one?
3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one has a molecular weight of 2269.83 g/mol, XLogP of 18.06, 21 rotatable bonds, 7 hydrogen bond donors, and 25 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2,1,3-benzoxadiazol-5-yl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-fluoropyrimidin-4-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-(5-methylpyrazin-2-yl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;2-[2-[8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]phenoxy]acetamide;8-(dimethylamino)-8-phenyl-3-pyrazin-2-yl-1,3-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 158943290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).