N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide

C244H313F3N24O33 — CID 167545727

IUPACN-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide
SMILESC.C.CC(=O)C[C@@H](NC(=O)C(CC(C)C)n1ccccc1=O)c1cccc(C(C)(C)C)c1.CC(=O)C[C@@H](NC(=O)C(CC(C)C)n1ccccc1=O)c1cccc(OC2CCC2)c1.CC(=O)C[C@@H](NC(=O)C(CC(C)C)n1ccccc1=O)c1cccc(Oc2ccccc2)c1.CC(=O)C[C@H](NC(=O)C(CC(C)C)n1ccc(C)cc1=O)c1cncc(N2CCOC(C)(C)C2C)c1.CC(=O)C[C@H](NC(=O)[C@H](CC(C)C)N1CC[C@H](C(F)(F)F)CC1=O)c1cncc(-c2c(C)cccc2C)c1.CC(=O)C[C@H](NC(=O)[C@H](CC(C)C)n1ccccc1=O)c1cccc(N2CCC[C@@H]2C)c1.CC(=O)C[C@H](NC(=O)[C@H](CC(C)C)n1ccccc1=O)c1cncc(-c2c(C)cccc2C)c1.COC[C@@H](C(=O)N[C@@H](CC(=O)O)c1cccc(-c2c(C)cccc2C)c1)n1ccc(C)cc1=O.Cc1cccc(C)c1-c1cncc([C@@H](CC(=O)O)NC(=O)C(CC(C)C)N2CCCCC2=O)c1
InChIInChI=1S/C29H36F3N3O3.C28H40N4O4.C28H33N3O3.C27H35N3O4.C27H30N2O5.C27H30N2O4.C26H35N3O3.C25H32N2O4.C25H34N2O3.2CH4/c1-17(2)11-25(35-10-9-23(14-26(35)37)29(30,31)32)28(38)34-24(12-20(5)36)21-13-22(16-33-15-21)27-18(3)7-6-8-19(27)4;1-18(2)12-25(32-9-8-19(3)13-26(32)34)27(35)30-24(14-20(4)33)22-15-23(17-29-16-22)31-10-11-36-28(6,7)21(31)5;1-18(2)13-25(31-12-7-6-11-26(31)33)28(34)30-24(14-21(5)32)22-15-23(17-29-16-22)27-19(3)9-8-10-20(27)4;1-17(2)12-23(30-11-6-5-10-24(30)31)27(34)29-22(14-25(32)33)20-13-21(16-28-15-20)26-18(3)8-7-9-19(26)4;1-17-11-12-29(24(30)13-17)23(16-34-4)27(33)28-22(15-25(31)32)20-9-6-10-21(14-20)26-18(2)7-5-8-19(26)3;1-19(2)16-25(29-15-8-7-14-26(29)31)27(32)28-24(17-20(3)30)21-10-9-13-23(18-21)33-22-11-5-4-6-12-22;1-18(2)15-24(29-13-6-5-12-25(29)31)26(32)27-23(16-20(4)30)21-10-7-11-22(17-21)28-14-8-9-19(28)3;1-17(2)14-23(27-13-5-4-12-24(27)29)25(30)26-22(15-18(3)28)19-8-6-11-21(16-19)31-20-9-7-10-20;1-17(2)14-22(27-13-8-7-12-23(27)29)24(30)26-21(15-18(3)28)19-10-9-11-20(16-19)25(4,5)6;;/h6-8,13,15-17,23-25H,9-12,14H2,1-5H3,(H,34,38);8-9,13,15-18,21,24-25H,10-12,14H2,1-7H3,(H,30,35);6-12,15-18,24-25H,13-14H2,1-5H3,(H,30,34);7-9,13,15-17,22-23H,5-6,10-12,14H2,1-4H3,(H,29,34)(H,32,33);5-14,22-23H,15-16H2,1-4H3,(H,28,33)(H,31,32);4-15,18-19,24-25H,16-17H2,1-3H3,(H,28,32);5-7,10-13,17-19,23-24H,8-9,14-16H2,1-4H3,(H,27,32);4-6,8,11-13,16-17,20,22-23H,7,9-10,14-15H2,1-3H3,(H,26,30);7-13,16-17,21-22H,14-15H2,1-6H3,(H,26,30);2*1H4/t23-,24-,25-;21?,24-,25?;24-,25-;22-,23?;22-,23-;24-,25?;19-,23-,24-;22-,23?;21-,22?;;/m000101011../s1
InChIKeyBTNLDRLOWLVSTP-SIFSOVRNSA-N
MW4167.32 g/mol
LogP42.40
Rot. Bonds82

About N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide

N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide (PubChem CID 167545727) has the molecular formula C244H313F3N24O33 and a molecular weight of 4167.32 g/mol. Its IUPAC name is N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide.

Molecular Properties

Compound NameN-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide
PubChem CID167545727
Molecular FormulaC244H313F3N24O33
Molecular Weight4167.32 g/mol
Exact Mass4164.35
IUPAC NameN-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide
SMILESC.C.CC(=O)C[C@@H](NC(=O)C(CC(C)C)n1ccccc1=O)c1cccc(C(C)(C)C)c1.CC(=O)C[C@@H](NC(=O)C(CC(C)C)n1ccccc1=O)c1cccc(OC2CCC2)c1.CC(=O)C[C@@H](NC(=O)C(CC(C)C)n1ccccc1=O)c1cccc(Oc2ccccc2)c1.CC(=O)C[C@H](NC(=O)C(CC(C)C)n1ccc(C)cc1=O)c1cncc(N2CCOC(C)(C)C2C)c1.CC(=O)C[C@H](NC(=O)[C@H](CC(C)C)N1CC[C@H](C(F)(F)F)CC1=O)c1cncc(-c2c(C)cccc2C)c1.CC(=O)C[C@H](NC(=O)[C@H](CC(C)C)n1ccccc1=O)c1cccc(N2CCC[C@@H]2C)c1.CC(=O)C[C@H](NC(=O)[C@H](CC(C)C)n1ccccc1=O)c1cncc(-c2c(C)cccc2C)c1.COC[C@@H](C(=O)N[C@@H](CC(=O)O)c1cccc(-c2c(C)cccc2C)c1)n1ccc(C)cc1=O.Cc1cccc(C)c1-c1cncc([C@@H](CC(=O)O)NC(=O)C(CC(C)C)N2CCCCC2=O)c1
InChIInChI=1S/C29H36F3N3O3.C28H40N4O4.C28H33N3O3.C27H35N3O4.C27H30N2O5.C27H30N2O4.C26H35N3O3.C25H32N2O4.C25H34N2O3.2CH4/c1-17(2)11-25(35-10-9-23(14-26(35)37)29(30,31)32)28(38)34-24(12-20(5)36)21-13-22(16-33-15-21)27-18(3)7-6-8-19(27)4;1-18(2)12-25(32-9-8-19(3)13-26(32)34)27(35)30-24(14-20(4)33)22-15-23(17-29-16-22)31-10-11-36-28(6,7)21(31)5;1-18(2)13-25(31-12-7-6-11-26(31)33)28(34)30-24(14-21(5)32)22-15-23(17-29-16-22)27-19(3)9-8-10-20(27)4;1-17(2)12-23(30-11-6-5-10-24(30)31)27(34)29-22(14-25(32)33)20-13-21(16-28-15-20)26-18(3)8-7-9-19(26)4;1-17-11-12-29(24(30)13-17)23(16-34-4)27(33)28-22(15-25(31)32)20-9-6-10-21(14-20)26-18(2)7-5-8-19(26)3;1-19(2)16-25(29-15-8-7-14-26(29)31)27(32)28-24(17-20(3)30)21-10-9-13-23(18-21)33-22-11-5-4-6-12-22;1-18(2)15-24(29-13-6-5-12-25(29)31)26(32)27-23(16-20(4)30)21-10-7-11-22(17-21)28-14-8-9-19(28)3;1-17(2)14-23(27-13-5-4-12-24(27)29)25(30)26-22(15-18(3)28)19-8-6-11-21(16-19)31-20-9-7-10-20;1-17(2)14-22(27-13-8-7-12-23(27)29)24(30)26-21(15-18(3)28)19-10-9-11-20(16-19)25(4,5)6;;/h6-8,13,15-17,23-25H,9-12,14H2,1-5H3,(H,34,38);8-9,13,15-18,21,24-25H,10-12,14H2,1-7H3,(H,30,35);6-12,15-18,24-25H,13-14H2,1-5H3,(H,30,34);7-9,13,15-17,22-23H,5-6,10-12,14H2,1-4H3,(H,29,34)(H,32,33);5-14,22-23H,15-16H2,1-4H3,(H,28,33)(H,31,32);4-15,18-19,24-25H,16-17H2,1-3H3,(H,28,32);5-7,10-13,17-19,23-24H,8-9,14-16H2,1-4H3,(H,27,32);4-6,8,11-13,16-17,20,22-23H,7,9-10,14-15H2,1-3H3,(H,26,30);7-13,16-17,21-22H,14-15H2,1-6H3,(H,26,30);2*1H4/t23-,24-,25-;21?,24-,25?;24-,25-;22-,23?;22-,23-;24-,25?;19-,23-,24-;22-,23?;21-,22?;;/m000101011../s1
InChIKeyBTNLDRLOWLVSTP-SIFSOVRNSA-N
XLogP42.40
TPSA745.57 Ų
H-Bond Donors11
H-Bond Acceptors44
Rotatable Bonds82
Heavy Atoms304
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5004167.32
LogP ≤ 542.40
H-Bond Donors ≤ 511
H-Bond Acceptors ≤ 1044

Analyze N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide?
The IUPAC name of N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide (CID 167545727) is N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide.
What is the SMILES notation for N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide?
The canonical SMILES for N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide is C.C.CC(=O)C[C@@H](NC(=O)C(CC(C)C)n1ccccc1=O)c1cccc(C(C)(C)C)c1.CC(=O)C[C@@H](NC(=O)C(CC(C)C)n1ccccc1=O)c1cccc(OC2CCC2)c1.CC(=O)C[C@@H](NC(=O)C(CC(C)C)n1ccccc1=O)c1cccc(Oc2ccccc2)c1.CC(=O)C[C@H](NC(=O)C(CC(C)C)n1ccc(C)cc1=O)c1cncc(N2CCOC(C)(C)C2C)c1.CC(=O)C[C@H](NC(=O)[C@H](CC(C)C)N1CC[C@H](C(F)(F)F)CC1=O)c1cncc(-c2c(C)cccc2C)c1.CC(=O)C[C@H](NC(=O)[C@H](CC(C)C)n1ccccc1=O)c1cccc(N2CCC[C@@H]2C)c1.CC(=O)C[C@H](NC(=O)[C@H](CC(C)C)n1ccccc1=O)c1cncc(-c2c(C)cccc2C)c1.COC[C@@H](C(=O)N[C@@H](CC(=O)O)c1cccc(-c2c(C)cccc2C)c1)n1ccc(C)cc1=O.Cc1cccc(C)c1-c1cncc([C@@H](CC(=O)O)NC(=O)C(CC(C)C)N2CCCCC2=O)c1.
What is the InChIKey of N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide?
The InChIKey is BTNLDRLOWLVSTP-SIFSOVRNSA-N. The full InChI is InChI=1S/C29H36F3N3O3.C28H40N4O4.C28H33N3O3.C27H35N3O4.C27H30N2O5.C27H30N2O4.C26H35N3O3.C25H32N2O4.C25H34N2O3.2CH4/c1-17(2)11-25(35-10-9-23(14-26(35)37)29(30,31)32)28(38)34-24(12-20(5)36)21-13-22(16-33-15-21)27-18(3)7-6-8-19(27)4;1-18(2)12-25(32-9-8-19(3)13-26(32)34)27(35)30-24(14-20(4)33)22-15-23(17-29-16-22)31-10-11-36-28(6,7)21(31)5;1-18(2)13-25(31-12-7-6-11-26(31)33)28(34)30-24(14-21(5)32)22-15-23(17-29-16-22)27-19(3)9-8-10-20(27)4;1-17(2)12-23(30-11-6-5-10-24(30)31)27(34)29-22(14-25(32)33)20-13-21(16-28-15-20)26-18(3)8-7-9-19(26)4;1-17-11-12-29(24(30)13-17)23(16-34-4)27(33)28-22(15-25(31)32)20-9-6-10-21(14-20)26-18(2)7-5-8-19(26)3;1-19(2)16-25(29-15-8-7-14-26(29)31)27(32)28-24(17-20(3)30)21-10-9-13-23(18-21)33-22-11-5-4-6-12-22;1-18(2)15-24(29-13-6-5-12-25(29)31)26(32)27-23(16-20(4)30)21-10-7-11-22(17-21)28-14-8-9-19(28)3;1-17(2)14-23(27-13-5-4-12-24(27)29)25(30)26-22(15-18(3)28)19-8-6-11-21(16-19)31-20-9-7-10-20;1-17(2)14-22(27-13-8-7-12-23(27)29)24(30)26-21(15-18(3)28)19-10-9-11-20(16-19)25(4,5)6;;/h6-8,13,15-17,23-25H,9-12,14H2,1-5H3,(H,34,38);8-9,13,15-18,21,24-25H,10-12,14H2,1-7H3,(H,30,35);6-12,15-18,24-25H,13-14H2,1-5H3,(H,30,34);7-9,13,15-17,22-23H,5-6,10-12,14H2,1-4H3,(H,29,34)(H,32,33);5-14,22-23H,15-16H2,1-4H3,(H,28,33)(H,31,32);4-15,18-19,24-25H,16-17H2,1-3H3,(H,28,32);5-7,10-13,17-19,23-24H,8-9,14-16H2,1-4H3,(H,27,32);4-6,8,11-13,16-17,20,22-23H,7,9-10,14-15H2,1-3H3,(H,26,30);7-13,16-17,21-22H,14-15H2,1-6H3,(H,26,30);2*1H4/t23-,24-,25-;21?,24-,25?;24-,25-;22-,23?;22-,23-;24-,25?;19-,23-,24-;22-,23?;21-,22?;;/m000101011../s1.
What are the key properties of N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide?
N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide has a molecular weight of 4167.32 g/mol, XLogP of 42.40, 82 rotatable bonds, 11 hydrogen bond donors, and 44 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(3-tert-butylphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;N-[(1R)-1-(3-cyclobutyloxyphenyl)-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(3S)-3-[3-(2,6-dimethylphenyl)phenyl]-3-[[(2S)-3-methoxy-2-(4-methyl-2-oxo-1-pyridinyl)propanoyl]amino]propanoic acid;(3R)-3-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-[[4-methyl-2-(2-oxopiperidin-1-yl)pentanoyl]amino]propanoic acid;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-(2-oxo-1-pyridinyl)pentanamide;(2S)-N-[(1S)-1-[5-(2,6-dimethylphenyl)-3-pyridinyl]-3-oxobutyl]-4-methyl-2-[(4S)-2-oxo-4-(trifluoromethyl)piperidin-1-yl]pentanamide;methane;(2R)-4-methyl-2-(4-methyl-2-oxo-1-pyridinyl)-N-[(1S)-3-oxo-1-[5-(2,2,3-trimethylmorpholin-4-yl)-3-pyridinyl]butyl]pentanamide;(2S)-4-methyl-N-[(1S)-1-[3-[(2S)-2-methylpyrrolidin-1-yl]phenyl]-3-oxobutyl]-2-(2-oxo-1-pyridinyl)pentanamide;4-methyl-N-[(1R)-3-oxo-1-(3-phenoxyphenyl)butyl]-2-(2-oxo-1-pyridinyl)pentanamide is sourced from PubChem (CID 167545727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).