N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one

C233H307N29O19 — CID 161186205

IUPACN-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one
SMILESCCN1C(=O)N(Cc2cccnc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COc1ccc(C#N)cc1CN1CC2(CCC(c3ccccc3)(N(C)C)CC2)N(CC2(O)CCC2)C1=O.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)NCC#N)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCCCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCOCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CCC3(OC)CCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(Cc3cccnc3)C2=O)cc1
InChIInChI=1S/C31H43N3O3.C31H43N3O2.C30H38N4O3.C30H36N4O2.C30H41N3O3.C29H39N3O2.C28H35N5O3.C24H32N4O/c1-32(2)31(26-9-6-5-7-10-26)19-17-29(18-20-31)24-33(23-25-11-13-27(36-3)14-12-25)28(35)34(29)22-21-30(37-4)15-8-16-30;1-32(2)31(27-12-8-5-9-13-27)20-18-30(19-21-31)24-33(22-26-14-16-28(36-3)17-15-26)29(35)34(30)23-25-10-6-4-7-11-25;1-32(2)30(25-8-5-4-6-9-25)16-14-28(15-17-30)21-33(27(35)34(28)22-29(36)12-7-13-29)20-24-18-23(19-31)10-11-26(24)37-3;1-32(2)30(26-9-5-4-6-10-26)17-15-29(16-18-30)23-33(21-24-11-13-27(36-3)14-12-24)28(35)34(29)22-25-8-7-19-31-20-25;1-31(2)30(26-7-5-4-6-8-26)17-15-29(16-18-30)23-32(21-24-9-11-27(35-3)12-10-24)28(34)33(29)22-25-13-19-36-20-14-25;1-30(2)29(25-10-5-4-6-11-25)18-16-28(17-19-29)22-31(20-24-12-14-26(34-3)15-13-24)27(33)32(28)21-23-8-7-9-23;1-31(2)28(23-7-5-4-6-8-23)15-13-27(14-16-28)21-32(19-22-9-11-24(36-3)12-10-22)26(35)33(27)20-25(34)30-18-17-29;1-4-28-22(29)27(18-20-9-8-16-25-17-20)19-23(28)12-14-24(15-13-23,26(2)3)21-10-6-5-7-11-21/h5-7,9-14H,8,15-24H2,1-4H3;5,8-9,12-17,25H,4,6-7,10-11,18-24H2,1-3H3;4-6,8-11,18,36H,7,12-17,20-22H2,1-3H3;4-14,19-20H,15-18,21-23H2,1-3H3;4-12,25H,13-23H2,1-3H3;4-6,10-15,23H,7-9,16-22H2,1-3H3;4-12H,13-16,18-21H2,1-3H3,(H,30,34);5-11,16-17H,4,12-15,18-19H2,1-3H3
InChIKeyUTCNYLFMSOUPOT-UHFFFAOYSA-N
MW3818.20 g/mol
LogP39.82
Rot. Bonds57

About N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one

N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one (PubChem CID 161186205) has the molecular formula C233H307N29O19 and a molecular weight of 3818.20 g/mol. Its IUPAC name is N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one.

Molecular Properties

Compound NameN-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one
PubChem CID161186205
Molecular FormulaC233H307N29O19
Molecular Weight3818.20 g/mol
Exact Mass3815.39
IUPAC NameN-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one
SMILESCCN1C(=O)N(Cc2cccnc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COc1ccc(C#N)cc1CN1CC2(CCC(c3ccccc3)(N(C)C)CC2)N(CC2(O)CCC2)C1=O.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)NCC#N)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCCCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCOCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CCC3(OC)CCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(Cc3cccnc3)C2=O)cc1
InChIInChI=1S/C31H43N3O3.C31H43N3O2.C30H38N4O3.C30H36N4O2.C30H41N3O3.C29H39N3O2.C28H35N5O3.C24H32N4O/c1-32(2)31(26-9-6-5-7-10-26)19-17-29(18-20-31)24-33(23-25-11-13-27(36-3)14-12-25)28(35)34(29)22-21-30(37-4)15-8-16-30;1-32(2)31(27-12-8-5-9-13-27)20-18-30(19-21-31)24-33(22-26-14-16-28(36-3)17-15-26)29(35)34(30)23-25-10-6-4-7-11-25;1-32(2)30(25-8-5-4-6-9-25)16-14-28(15-17-30)21-33(27(35)34(28)22-29(36)12-7-13-29)20-24-18-23(19-31)10-11-26(24)37-3;1-32(2)30(26-9-5-4-6-10-26)17-15-29(16-18-30)23-33(21-24-11-13-27(36-3)14-12-24)28(35)34(29)22-25-8-7-19-31-20-25;1-31(2)30(26-7-5-4-6-8-26)17-15-29(16-18-30)23-32(21-24-9-11-27(35-3)12-10-24)28(34)33(29)22-25-13-19-36-20-14-25;1-30(2)29(25-10-5-4-6-11-25)18-16-28(17-19-29)22-31(20-24-12-14-26(34-3)15-13-24)27(33)32(28)21-23-8-7-9-23;1-31(2)28(23-7-5-4-6-8-23)15-13-27(14-16-28)21-32(19-22-9-11-24(36-3)12-10-22)26(35)33(27)20-25(34)30-18-17-29;1-4-28-22(29)27(18-20-9-8-16-25-17-20)19-23(28)12-14-24(15-13-23,26(2)3)21-10-6-5-7-11-21/h5-7,9-14H,8,15-24H2,1-4H3;5,8-9,12-17,25H,4,6-7,10-11,18-24H2,1-3H3;4-6,8-11,18,36H,7,12-17,20-22H2,1-3H3;4-14,19-20H,15-18,21-23H2,1-3H3;4-12,25H,13-23H2,1-3H3;4-6,10-15,23H,7-9,16-22H2,1-3H3;4-12H,13-16,18-21H2,1-3H3,(H,30,34);5-11,16-17H,4,12-15,18-19H2,1-3H3
InChIKeyUTCNYLFMSOUPOT-UHFFFAOYSA-N
XLogP39.82
TPSA420.08 Ų
H-Bond Donors2
H-Bond Acceptors31
Rotatable Bonds57
Heavy Atoms281
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003818.20
LogP ≤ 539.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1031

Computed Properties (RDKit)

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

Analyze N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one with MolForge

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one?
The IUPAC name of N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one (CID 161186205) is N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one.
What is the SMILES notation for N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one?
The canonical SMILES for N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one is CCN1C(=O)N(Cc2cccnc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COc1ccc(C#N)cc1CN1CC2(CCC(c3ccccc3)(N(C)C)CC2)N(CC2(O)CCC2)C1=O.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)NCC#N)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCCCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC3CCOCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CCC3(OC)CCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(Cc3cccnc3)C2=O)cc1.
What is the InChIKey of N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one?
The InChIKey is UTCNYLFMSOUPOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H43N3O3.C31H43N3O2.C30H38N4O3.C30H36N4O2.C30H41N3O3.C29H39N3O2.C28H35N5O3.C24H32N4O/c1-32(2)31(26-9-6-5-7-10-26)19-17-29(18-20-31)24-33(23-25-11-13-27(36-3)14-12-25)28(35)34(29)22-21-30(37-4)15-8-16-30;1-32(2)31(27-12-8-5-9-13-27)20-18-30(19-21-31)24-33(22-26-14-16-28(36-3)17-15-26)29(35)34(30)23-25-10-6-4-7-11-25;1-32(2)30(25-8-5-4-6-9-25)16-14-28(15-17-30)21-33(27(35)34(28)22-29(36)12-7-13-29)20-24-18-23(19-31)10-11-26(24)37-3;1-32(2)30(26-9-5-4-6-10-26)17-15-29(16-18-30)23-33(21-24-11-13-27(36-3)14-12-24)28(35)34(29)22-25-8-7-19-31-20-25;1-31(2)30(26-7-5-4-6-8-26)17-15-29(16-18-30)23-32(21-24-9-11-27(35-3)12-10-24)28(34)33(29)22-25-13-19-36-20-14-25;1-30(2)29(25-10-5-4-6-11-25)18-16-28(17-19-29)22-31(20-24-12-14-26(34-3)15-13-24)27(33)32(28)21-23-8-7-9-23;1-31(2)28(23-7-5-4-6-8-23)15-13-27(14-16-28)21-32(19-22-9-11-24(36-3)12-10-22)26(35)33(27)20-25(34)30-18-17-29;1-4-28-22(29)27(18-20-9-8-16-25-17-20)19-23(28)12-14-24(15-13-23,26(2)3)21-10-6-5-7-11-21/h5-7,9-14H,8,15-24H2,1-4H3;5,8-9,12-17,25H,4,6-7,10-11,18-24H2,1-3H3;4-6,8-11,18,36H,7,12-17,20-22H2,1-3H3;4-14,19-20H,15-18,21-23H2,1-3H3;4-12,25H,13-23H2,1-3H3;4-6,10-15,23H,7-9,16-22H2,1-3H3;4-12H,13-16,18-21H2,1-3H3,(H,30,34);5-11,16-17H,4,12-15,18-19H2,1-3H3.
What are the key properties of N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one?
N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one has a molecular weight of 3818.20 g/mol, XLogP of 39.82, 57 rotatable bonds, 2 hydrogen bond donors, and 31 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyanomethyl)-2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]acetamide;1-(cyclobutylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;1-(cyclohexylmethyl)-8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-ethyl-8-phenyl-3-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one;3-[[8-(dimethylamino)-1-[(1-hydroxycyclobutyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-3-yl]methyl]-4-methoxybenzonitrile;8-(dimethylamino)-1-[2-(1-methoxycyclobutyl)ethyl]-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(oxan-4-ylmethyl)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1-(pyridin-3-ylmethyl)-1,3-diazaspiro[4.5]decan-2-one is sourced from PubChem (CID 161186205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).