3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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

C228H301N29O22 — CID 159673548

IUPAC3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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
SMILESCN(C)C1(c2ccccc2)CCC2(CC1)CN(Cc1ccccc1)C(=O)N2CC1CCC1.COCCCC(=O)CN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COCCCC1(N(C)C)CCC2(CC1)CN(Cc1ccc(OC)cc1)C(=O)N2.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)CC3(C#N)CC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)CCC#N)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)N(C)C)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)N3CCCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(Cc3cccnc3)C2=O)cc1
InChIInChI=1S/C31H38N4O3.C30H40N4O3.C30H36N4O2.C30H41N3O4.C29H36N4O3.C28H38N4O3.C28H37N3O.C22H35N3O3/c1-33(2)31(25-7-5-4-6-8-25)17-15-30(16-18-31)23-34(20-24-9-11-27(38-3)12-10-24)28(37)35(30)21-26(36)19-29(22-32)13-14-29;1-31(2)30(25-9-5-4-6-10-25)17-15-29(16-18-30)23-33(21-24-11-13-26(37-3)14-12-24)28(36)34(29)22-27(35)32-19-7-8-20-32;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(25-9-6-5-7-10-25)18-16-29(17-19-30)23-32(21-24-12-14-27(37-4)15-13-24)28(35)33(29)22-26(34)11-8-20-36-3;1-31(2)29(24-8-5-4-6-9-24)17-15-28(16-18-29)22-32(20-23-11-13-26(36-3)14-12-23)27(35)33(28)21-25(34)10-7-19-30;1-29(2)25(33)20-32-26(34)31(19-22-11-13-24(35-5)14-12-22)21-27(32)15-17-28(18-16-27,30(3)4)23-9-7-6-8-10-23;1-29(2)28(25-14-7-4-8-15-25)18-16-27(17-19-28)22-30(20-23-10-5-3-6-11-23)26(32)31(27)21-24-12-9-13-24;1-24(2)22(10-5-15-27-3)13-11-21(12-14-22)17-25(20(26)23-21)16-18-6-8-19(28-4)9-7-18/h4-12H,13-21,23H2,1-3H3;4-6,9-14H,7-8,15-23H2,1-3H3;4-14,19-20H,15-18,21-23H2,1-3H3;5-7,9-10,12-15H,8,11,16-23H2,1-4H3;4-6,8-9,11-14H,7,10,15-18,20-22H2,1-3H3;6-14H,15-21H2,1-5H3;3-8,10-11,14-15,24H,9,12-13,16-22H2,1-2H3;6-9H,5,10-17H2,1-4H3,(H,23,26)
InChIKeyMUHNYPBRAMWZAB-UHFFFAOYSA-N
MW3800.10 g/mol
LogP36.41
Rot. Bonds64

About 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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

3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 159673548) has the molecular formula C228H301N29O22 and a molecular weight of 3800.10 g/mol. Its IUPAC name is 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 Name3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 CID159673548
Molecular FormulaC228H301N29O22
Molecular Weight3800.10 g/mol
Exact Mass3797.33
IUPAC Name3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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
SMILESCN(C)C1(c2ccccc2)CCC2(CC1)CN(Cc1ccccc1)C(=O)N2CC1CCC1.COCCCC(=O)CN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COCCCC1(N(C)C)CCC2(CC1)CN(Cc1ccc(OC)cc1)C(=O)N2.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)CC3(C#N)CC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)CCC#N)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)N(C)C)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)N3CCCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(Cc3cccnc3)C2=O)cc1
InChIInChI=1S/C31H38N4O3.C30H40N4O3.C30H36N4O2.C30H41N3O4.C29H36N4O3.C28H38N4O3.C28H37N3O.C22H35N3O3/c1-33(2)31(25-7-5-4-6-8-25)17-15-30(16-18-31)23-34(20-24-9-11-27(38-3)12-10-24)28(37)35(30)21-26(36)19-29(22-32)13-14-29;1-31(2)30(25-9-5-4-6-10-25)17-15-29(16-18-30)23-33(21-24-11-13-26(37-3)14-12-24)28(36)34(29)22-27(35)32-19-7-8-20-32;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(25-9-6-5-7-10-25)18-16-29(17-19-30)23-32(21-24-12-14-27(37-4)15-13-24)28(35)33(29)22-26(34)11-8-20-36-3;1-31(2)29(24-8-5-4-6-9-24)17-15-28(16-18-29)22-32(20-23-11-13-26(36-3)14-12-23)27(35)33(28)21-25(34)10-7-19-30;1-29(2)25(33)20-32-26(34)31(19-22-11-13-24(35-5)14-12-22)21-27(32)15-17-28(18-16-27,30(3)4)23-9-7-6-8-10-23;1-29(2)28(25-14-7-4-8-15-25)18-16-27(17-19-28)22-30(20-23-10-5-3-6-11-23)26(32)31(27)21-24-12-9-13-24;1-24(2)22(10-5-15-27-3)13-11-21(12-14-22)17-25(20(26)23-21)16-18-6-8-19(28-4)9-7-18/h4-12H,13-21,23H2,1-3H3;4-6,9-14H,7-8,15-23H2,1-3H3;4-14,19-20H,15-18,21-23H2,1-3H3;5-7,9-10,12-15H,8,11,16-23H2,1-4H3;4-6,8-9,11-14H,7,10,15-18,20-22H2,1-3H3;6-14H,15-21H2,1-5H3;3-8,10-11,14-15,24H,9,12-13,16-22H2,1-2H3;6-9H,5,10-17H2,1-4H3,(H,23,26)
InChIKeyMUHNYPBRAMWZAB-UHFFFAOYSA-N
XLogP36.41
TPSA458.48 Ų
H-Bond Donors1
H-Bond Acceptors33
Rotatable Bonds64
Heavy Atoms279
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003800.10
LogP ≤ 536.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1033

Computed Properties (RDKit)

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

Analyze 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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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Frequently Asked Questions

What is the IUPAC name of 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 159673548) is 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 CN(C)C1(c2ccccc2)CCC2(CC1)CN(Cc1ccccc1)C(=O)N2CC1CCC1.COCCCC(=O)CN1C(=O)N(Cc2ccc(OC)cc2)CC12CCC(c1ccccc1)(N(C)C)CC2.COCCCC1(N(C)C)CCC2(CC1)CN(Cc1ccc(OC)cc1)C(=O)N2.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)CC3(C#N)CC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)CCC#N)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)N(C)C)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(CC(=O)N3CCCC3)C2=O)cc1.COc1ccc(CN2CC3(CCC(c4ccccc4)(N(C)C)CC3)N(Cc3cccnc3)C2=O)cc1.
What is the InChIKey of 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 MUHNYPBRAMWZAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H38N4O3.C30H40N4O3.C30H36N4O2.C30H41N3O4.C29H36N4O3.C28H38N4O3.C28H37N3O.C22H35N3O3/c1-33(2)31(25-7-5-4-6-8-25)17-15-30(16-18-31)23-34(20-24-9-11-27(38-3)12-10-24)28(37)35(30)21-26(36)19-29(22-32)13-14-29;1-31(2)30(25-9-5-4-6-10-25)17-15-29(16-18-30)23-33(21-24-11-13-26(37-3)14-12-24)28(36)34(29)22-27(35)32-19-7-8-20-32;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(25-9-6-5-7-10-25)18-16-29(17-19-30)23-32(21-24-12-14-27(37-4)15-13-24)28(35)33(29)22-26(34)11-8-20-36-3;1-31(2)29(24-8-5-4-6-9-24)17-15-28(16-18-29)22-32(20-23-11-13-26(36-3)14-12-23)27(35)33(28)21-25(34)10-7-19-30;1-29(2)25(33)20-32-26(34)31(19-22-11-13-24(35-5)14-12-22)21-27(32)15-17-28(18-16-27,30(3)4)23-9-7-6-8-10-23;1-29(2)28(25-14-7-4-8-15-25)18-16-27(17-19-28)22-30(20-23-10-5-3-6-11-23)26(32)31(27)21-24-12-9-13-24;1-24(2)22(10-5-15-27-3)13-11-21(12-14-22)17-25(20(26)23-21)16-18-6-8-19(28-4)9-7-18/h4-12H,13-21,23H2,1-3H3;4-6,9-14H,7-8,15-23H2,1-3H3;4-14,19-20H,15-18,21-23H2,1-3H3;5-7,9-10,12-15H,8,11,16-23H2,1-4H3;4-6,8-9,11-14H,7,10,15-18,20-22H2,1-3H3;6-14H,15-21H2,1-5H3;3-8,10-11,14-15,24H,9,12-13,16-22H2,1-2H3;6-9H,5,10-17H2,1-4H3,(H,23,26).
What are the key properties of 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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?
3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 3800.10 g/mol, XLogP of 36.41, 64 rotatable bonds, 1 hydrogen bond donors, and 33 hydrogen bond acceptors.
Where does this data come from?
All data for 3-benzyl-1-(cyclobutylmethyl)-8-(dimethylamino)-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-1-(5-methoxy-2-oxopentyl)-3-[(4-methoxyphenyl)methyl]-8-phenyl-1,3-diazaspiro[4.5]decan-2-one;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-8-(3-methoxypropyl)-1,3-diazaspiro[4.5]decan-2-one;2-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-N,N-dimethylacetamide;5-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-4-oxopentanenitrile;1-[3-[8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-2-oxo-8-phenyl-1,3-diazaspiro[4.5]decan-1-yl]-2-oxopropyl]cyclopropane-1-carbonitrile;8-(dimethylamino)-3-[(4-methoxyphenyl)methyl]-1-(2-oxo-2-pyrrolidin-1-ylethyl)-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 159673548), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).