3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide

C214H297FN24O23 — CID 158616744

IUPAC3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide
SMILESCCCNC(=O)CCN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(Cc1cccc(C#N)c1)C(=O)N2CC1CCC1.CNC(=O)CCN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COCCOCCOCCOCCOCCOCCOCCOCCN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(C)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3(F)CCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CCC3CCCCC3)C2=O)cc1
InChIInChI=1S/C41H65N3O10.C32H45N3O2.C30H42N4O3.C29H38FN3O2.C29H36N4O.C28H38N4O3.C25H33N3O2/c1-42(2)41(37-8-6-5-7-9-37)16-14-40(15-17-41)35-43(34-36-10-12-38(47-4)13-11-36)39(45)44(40)18-19-48-22-23-50-26-27-52-30-31-54-33-32-53-29-28-51-25-24-49-21-20-46-3;1-33(2)32(28-12-8-5-9-13-28)21-19-31(20-22-32)25-34(24-27-14-16-29(37-3)17-15-27)30(36)35(31)23-18-26-10-6-4-7-11-26;1-5-20-31-27(35)15-21-34-28(36)33(22-24-11-13-26(37-4)14-12-24)23-29(34)16-18-30(19-17-29,32(2)3)25-9-7-6-8-10-25;1-31(2)29(24-8-5-4-6-9-24)18-16-28(17-19-29)22-32(20-23-10-12-25(35-3)13-11-23)26(34)33(28)21-27(30)14-7-15-27;1-31(2)29(26-12-4-3-5-13-26)16-14-28(15-17-29)22-32(20-25-11-7-10-24(18-25)19-30)27(34)33(28)21-23-8-6-9-23;1-29-25(33)14-19-32-26(34)31(20-22-10-12-24(35-4)13-11-22)21-27(32)15-17-28(18-16-27,30(2)3)23-8-6-5-7-9-23;1-26(2)25(21-8-6-5-7-9-21)16-14-24(15-17-25)19-28(23(29)27(24)3)18-20-10-12-22(30-4)13-11-20/h5-13H,14-35H2,1-4H3;5,8-9,12-17,26H,4,6-7,10-11,18-25H2,1-3H3;6-14H,5,15-23H2,1-4H3,(H,31,35);4-6,8-13H,7,14-22H2,1-3H3;3-5,7,10-13,18,23H,6,8-9,14-17,20-22H2,1-2H3;5-13H,14-21H2,1-4H3,(H,29,33);5-13H,14-19H2,1-4H3
InChIKeyHXMIDYFGWOSRKH-UHFFFAOYSA-N
MW3592.87 g/mol
LogP34.89
Rot. Bonds73

About 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide

3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide (PubChem CID 158616744) has the molecular formula C214H297FN24O23 and a molecular weight of 3592.87 g/mol. Its IUPAC name is 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide.

Molecular Properties

Compound Name3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide
PubChem CID158616744
Molecular FormulaC214H297FN24O23
Molecular Weight3592.87 g/mol
Exact Mass3590.28
IUPAC Name3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide
SMILESCCCNC(=O)CCN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(Cc1cccc(C#N)c1)C(=O)N2CC1CCC1.CNC(=O)CCN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COCCOCCOCCOCCOCCOCCOCCOCCN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(C)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3(F)CCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CCC3CCCCC3)C2=O)cc1
InChIInChI=1S/C41H65N3O10.C32H45N3O2.C30H42N4O3.C29H38FN3O2.C29H36N4O.C28H38N4O3.C25H33N3O2/c1-42(2)41(37-8-6-5-7-9-37)16-14-40(15-17-41)35-43(34-36-10-12-38(47-4)13-11-36)39(45)44(40)18-19-48-22-23-50-26-27-52-30-31-54-33-32-53-29-28-51-25-24-49-21-20-46-3;1-33(2)32(28-12-8-5-9-13-28)21-19-31(20-22-32)25-34(24-27-14-16-29(37-3)17-15-27)30(36)35(31)23-18-26-10-6-4-7-11-26;1-5-20-31-27(35)15-21-34-28(36)33(22-24-11-13-26(37-4)14-12-24)23-29(34)16-18-30(19-17-29,32(2)3)25-9-7-6-8-10-25;1-31(2)29(24-8-5-4-6-9-24)18-16-28(17-19-29)22-32(20-23-10-12-25(35-3)13-11-23)26(34)33(28)21-27(30)14-7-15-27;1-31(2)29(26-12-4-3-5-13-26)16-14-28(15-17-29)22-32(20-25-11-7-10-24(18-25)19-30)27(34)33(28)21-23-8-6-9-23;1-29-25(33)14-19-32-26(34)31(20-22-10-12-24(35-4)13-11-22)21-27(32)15-17-28(18-16-27,30(2)3)23-8-6-5-7-9-23;1-26(2)25(21-8-6-5-7-9-21)16-14-24(15-17-25)19-28(23(29)27(24)3)18-20-10-12-22(30-4)13-11-20/h5-13H,14-35H2,1-4H3;5,8-9,12-17,26H,4,6-7,10-11,18-25H2,1-3H3;6-14H,5,15-23H2,1-4H3,(H,31,35);4-6,8-13H,7,14-22H2,1-3H3;3-5,7,10-13,18,23H,6,8-9,14-17,20-22H2,1-2H3;5-13H,14-21H2,1-4H3,(H,29,33);5-13H,14-19H2,1-4H3
InChIKeyHXMIDYFGWOSRKH-UHFFFAOYSA-N
XLogP34.89
TPSA398.74 Ų
H-Bond Donors2
H-Bond Acceptors31
Rotatable Bonds73
Heavy Atoms262
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003592.87
LogP ≤ 534.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

Analyze 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide?
The IUPAC name of 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide (CID 158616744) is 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide.
What is the SMILES notation for 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide?
The canonical SMILES for 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide is CCCNC(=O)CCN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.CN(C)C1(c2ccccc2)CCC2(CC1)CN(Cc1cccc(C#N)c1)C(=O)N2CC1CCC1.CNC(=O)CCN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COCCOCCOCCOCCOCCOCCOCCOCCN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(C)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3(F)CCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CCC3CCCCC3)C2=O)cc1.
What is the InChIKey of 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide?
The InChIKey is HXMIDYFGWOSRKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C41H65N3O10.C32H45N3O2.C30H42N4O3.C29H38FN3O2.C29H36N4O.C28H38N4O3.C25H33N3O2/c1-42(2)41(37-8-6-5-7-9-37)16-14-40(15-17-41)35-43(34-36-10-12-38(47-4)13-11-36)39(45)44(40)18-19-48-22-23-50-26-27-52-30-31-54-33-32-53-29-28-51-25-24-49-21-20-46-3;1-33(2)32(28-12-8-5-9-13-28)21-19-31(20-22-32)25-34(24-27-14-16-29(37-3)17-15-27)30(36)35(31)23-18-26-10-6-4-7-11-26;1-5-20-31-27(35)15-21-34-28(36)33(22-24-11-13-26(37-4)14-12-24)23-29(34)16-18-30(19-17-29,32(2)3)25-9-7-6-8-10-25;1-31(2)29(24-8-5-4-6-9-24)18-16-28(17-19-29)22-32(20-23-10-12-25(35-3)13-11-23)26(34)33(28)21-27(30)14-7-15-27;1-31(2)29(26-12-4-3-5-13-26)16-14-28(15-17-29)22-32(20-25-11-7-10-24(18-25)19-30)27(34)33(28)21-23-8-6-9-23;1-29-25(33)14-19-32-26(34)31(20-22-10-12-24(35-4)13-11-22)21-27(32)15-17-28(18-16-27,30(2)3)23-8-6-5-7-9-23;1-26(2)25(21-8-6-5-7-9-21)16-14-24(15-17-25)19-28(23(29)27(24)3)18-20-10-12-22(30-4)13-11-20/h5-13H,14-35H2,1-4H3;5,8-9,12-17,26H,4,6-7,10-11,18-25H2,1-3H3;6-14H,5,15-23H2,1-4H3,(H,31,35);4-6,8-13H,7,14-22H2,1-3H3;3-5,7,10-13,18,23H,6,8-9,14-17,20-22H2,1-2H3;5-13H,14-21H2,1-4H3,(H,29,33);5-13H,14-19H2,1-4H3.
What are the key properties of 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide?
3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide has a molecular weight of 3592.87 g/mol, XLogP of 34.89, 73 rotatable bonds, 2 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[[1-(cyclobutylmethyl)-8-(dimethylamino)-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]benzonitrile;1-(2-cyclohexylethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[(1-fluorocyclobutyl)methyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-[2-[2-[2-[2-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-methyl-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-methylpropanamide;3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N-propylpropanamide is sourced from PubChem (CID 158616744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).