N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide

C156H147Cl7F5N23O14 — CID 159865253

IUPACN-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide
SMILESCC1CCC(NC(=O)C(=O)N2CCC(c3ccnc4ccccc34)CC2)CC1.Cc1ccc2c(C3CCN(C(=O)C(=O)Nc4ccc(Cl)cc4)CC3)ccnc2c1.O=C(Nc1ccc(CCCl)cc1)C(=O)N1CCC(c2ccnc3ccc(F)cc23)CC1.O=C(Nc1ccc(Cl)cc1)C(=O)N1CCC(c2ccnc3ccc(Cl)cc23)CC1.O=C(Nc1ccc(Cl)cc1)C(=O)N1CCC(c2ccnc3ccc(F)cc23)C(F)(F)C1.O=C(Nc1ccc(Cl)cn1)C(=O)N1CCC(c2ccnc3ccc(F)cc23)CC1.O=C(Nc1ccc(Cl)cn1)C(=O)N1CCC(c2ccnc3ccccc23)CC1
InChIInChI=1S/C24H23ClFN3O2.C23H22ClN3O2.C23H29N3O2.C22H19Cl2N3O2.C22H17ClF3N3O2.C21H18ClFN4O2.C21H19ClN4O2/c25-11-7-16-1-4-19(5-2-16)28-23(30)24(31)29-13-9-17(10-14-29)20-8-12-27-22-6-3-18(26)15-21(20)22;1-15-2-7-20-19(8-11-25-21(20)14-15)16-9-12-27(13-10-16)23(29)22(28)26-18-5-3-17(24)4-6-18;1-16-6-8-18(9-7-16)25-22(27)23(28)26-14-11-17(12-15-26)19-10-13-24-21-5-3-2-4-20(19)21;23-15-1-4-17(5-2-15)26-21(28)22(29)27-11-8-14(9-12-27)18-7-10-25-20-6-3-16(24)13-19(18)20;23-13-1-4-15(5-2-13)28-20(30)21(31)29-10-8-18(22(25,26)12-29)16-7-9-27-19-6-3-14(24)11-17(16)19;22-14-1-4-19(25-12-14)26-20(28)21(29)27-9-6-13(7-10-27)16-5-8-24-18-3-2-15(23)11-17(16)18;22-15-5-6-19(24-13-15)25-20(27)21(28)26-11-8-14(9-12-26)16-7-10-23-18-4-2-1-3-17(16)18/h1-6,8,12,15,17H,7,9-11,13-14H2,(H,28,30);2-8,11,14,16H,9-10,12-13H2,1H3,(H,26,28);2-5,10,13,16-18H,6-9,11-12,14-15H2,1H3,(H,25,27);1-7,10,13-14H,8-9,11-12H2,(H,26,28);1-7,9,11,18H,8,10,12H2,(H,28,30);1-5,8,11-13H,6-7,9-10H2,(H,25,26,28);1-7,10,13-14H,8-9,11-12H2,(H,24,25,27)
InChIKeyNRQOKENYLKDVAP-UHFFFAOYSA-N
MW2911.20 g/mol
LogP29.58
Rot. Bonds16

About N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide

N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide (PubChem CID 159865253) has the molecular formula C156H147Cl7F5N23O14 and a molecular weight of 2911.20 g/mol. Its IUPAC name is N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide.

Molecular Properties

Compound NameN-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide
PubChem CID159865253
Molecular FormulaC156H147Cl7F5N23O14
Molecular Weight2911.20 g/mol
Exact Mass2905.92
IUPAC NameN-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide
SMILESCC1CCC(NC(=O)C(=O)N2CCC(c3ccnc4ccccc34)CC2)CC1.Cc1ccc2c(C3CCN(C(=O)C(=O)Nc4ccc(Cl)cc4)CC3)ccnc2c1.O=C(Nc1ccc(CCCl)cc1)C(=O)N1CCC(c2ccnc3ccc(F)cc23)CC1.O=C(Nc1ccc(Cl)cc1)C(=O)N1CCC(c2ccnc3ccc(Cl)cc23)CC1.O=C(Nc1ccc(Cl)cc1)C(=O)N1CCC(c2ccnc3ccc(F)cc23)C(F)(F)C1.O=C(Nc1ccc(Cl)cn1)C(=O)N1CCC(c2ccnc3ccc(F)cc23)CC1.O=C(Nc1ccc(Cl)cn1)C(=O)N1CCC(c2ccnc3ccccc23)CC1
InChIInChI=1S/C24H23ClFN3O2.C23H22ClN3O2.C23H29N3O2.C22H19Cl2N3O2.C22H17ClF3N3O2.C21H18ClFN4O2.C21H19ClN4O2/c25-11-7-16-1-4-19(5-2-16)28-23(30)24(31)29-13-9-17(10-14-29)20-8-12-27-22-6-3-18(26)15-21(20)22;1-15-2-7-20-19(8-11-25-21(20)14-15)16-9-12-27(13-10-16)23(29)22(28)26-18-5-3-17(24)4-6-18;1-16-6-8-18(9-7-16)25-22(27)23(28)26-14-11-17(12-15-26)19-10-13-24-21-5-3-2-4-20(19)21;23-15-1-4-17(5-2-15)26-21(28)22(29)27-11-8-14(9-12-27)18-7-10-25-20-6-3-16(24)13-19(18)20;23-13-1-4-15(5-2-13)28-20(30)21(31)29-10-8-18(22(25,26)12-29)16-7-9-27-19-6-3-14(24)11-17(16)19;22-14-1-4-19(25-12-14)26-20(28)21(29)27-9-6-13(7-10-27)16-5-8-24-18-3-2-15(23)11-17(16)18;22-15-5-6-19(24-13-15)25-20(27)21(28)26-11-8-14(9-12-26)16-7-10-23-18-4-2-1-3-17(16)18/h1-6,8,12,15,17H,7,9-11,13-14H2,(H,28,30);2-8,11,14,16H,9-10,12-13H2,1H3,(H,26,28);2-5,10,13,16-18H,6-9,11-12,14-15H2,1H3,(H,25,27);1-7,10,13-14H,8-9,11-12H2,(H,26,28);1-7,9,11,18H,8,10,12H2,(H,28,30);1-5,8,11-13H,6-7,9-10H2,(H,25,26,28);1-7,10,13-14H,8-9,11-12H2,(H,24,25,27)
InChIKeyNRQOKENYLKDVAP-UHFFFAOYSA-N
XLogP29.58
TPSA461.88 Ų
H-Bond Donors7
H-Bond Acceptors23
Rotatable Bonds16
Heavy Atoms205
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002911.20
LogP ≤ 529.58
H-Bond Donors ≤ 57
H-Bond Acceptors ≤ 1023

Computed Properties (RDKit)

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

Analyze N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide with MolForge

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Related Compounds

6-chloro-1-[4-(dimethylamino)-2-propan-2-yl-3-pyridinyl]-4-(2,5-dimethyl-4-prop-2-enoylpiperazin-1-yl)-7-(2-fluorophenyl)pyrido[2,3-d]pyrimidin-2-one;N-[2-[6-chloro-4-(2,5-dimethyl-4-prop-2-enoylpiperazin-1-yl)-1-(4-methyl-2-propan-2-yl-3-pyridinyl)-2-oxopyrido[2,3-d]pyrimidin-7-yl]-3-fluorophenyl]-2,2,2-trifluoroacetamide
CID 157841416
N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-propan-2-ylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-cyclohexylphenyl)-2,6-dimethylpiperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2,6-dimethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-[3-fluoro-4-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-N-(3-iodophenyl)-2-methylpiperazine-1-carboxamide
CID 158570323
1-[4-[7-[6-Amino-3-(trifluoromethyl)-2-pyridinyl]-6-chloroquinazolin-4-yl]-2-methylpiperazin-1-yl]prop-2-en-1-one;6-[6-chloro-4-(3-methylpiperidin-1-yl)quinazolin-7-yl]-5-(trifluoromethyl)pyridin-2-amine;prop-2-enoyl chloride
CID 159016908
CID 159146868
CID 159146868
N-[2-[[3-chloro-5-(1,1-difluoroethyl)-2-pyridinyl]amino]ethyl]-2-methylpropanamide;N-(2,4-dimethylphenyl)-2-[4-(2-methylpropanoyl)piperazin-1-yl]acetamide;N-ethyl-N-(4-methylphenyl)-2-[4-(2-methylpropanoyl)piperazin-1-yl]acetamide;N-[(4-methylphenyl)methyl]-2-[4-(2-methylpropanoyl)piperazin-1-yl]acetamide;N-(4-methylphenyl)-2-[4-(2-methylpropanoyl)piperazin-1-yl]acetamide;2-[4-(2-methylpropanoyl)piperazin-1-yl]-N-(5-methyl-2-pyridinyl)acetamide;2-methyl-N-[2-(pyrimidin-2-ylamino)ethyl]propanamide
CID 160425951
(2R)-N-(4-butan-2-ylphenyl)-4-(3-fluoro-2-pyridinyl)-2-methylpiperazine-1-carboxamide;N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2,6-dimethylpiperazine-1-carboxamide;(2R)-N-(4-cyclohexylphenyl)-4-(3-fluoro-2-pyridinyl)-2-methylpiperazine-1-carboxamide;(2R)-N-(4-cyclopentylphenyl)-4-(3-fluoro-2-pyridinyl)-2-methylpiperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-2-methyl-N-[3-methyl-4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-2-methyl-N-[4-(4,4,4-trifluorobutan-2-yl)phenyl]piperazine-1-carboxamide
CID 160494595
(2R)-N-[2-(4-chlorophenyl)ethyl]-4-(3-chloro-2-pyridinyl)-2-methylpiperazine-1-carboxamide;N-[2-(3-chlorophenyl)ethyl]-4-(3-chloro-2-pyridinyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(2,2-diphenylethyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-[1-(4-fluorophenyl)-2-methylpropan-2-yl]piperazine-1-carboxamide;(2R)-4-(3-chloro-2-pyridinyl)-2-methyl-N-[2-[3-(trifluoromethyl)phenyl]ethyl]piperazine-1-carboxamide
CID 160746477
5-chloro-2-fluoro-N-propan-2-ylaniline;3,5-dichloro-N-propan-2-ylpyridin-2-amine;3,4-difluoro-N-propan-2-ylaniline;fluoromethane;6-fluoro-N-propan-2-ylquinolin-3-amine;2-fluoro-N-propan-2-yl-5-(trifluoromethyl)aniline;1-methyl-3-(propan-2-ylamino)quinolin-2-one;3-methyl-N-propan-2-ylbutan-1-amine;N-methyl-N-propan-2-ylquinolin-3-amine;3-phenyl-N-propan-2-ylaniline;4-phenyl-N-propan-2-ylaniline;3-(propan-2-ylamino)-1H-quinolin-2-one;2-propan-2-yl-3,4-dihydro-1H-isoquinoline;N-propan-2-yl-1,5-naphthyridin-3-amine;N-propan-2-ylquinolin-3-amine;bis(N-propan-2-ylquinolin-7-amine);N-propan-2-ylquinoxalin-2-amine;N-propan-2-yl-5,6,7,8-tetrahydroquinolin-3-amine;N-propan-2-yl-6-(trifluoromethyl)quinolin-3-amine;2,3,4-trifluoro-N-propan-2-ylaniline
CID 160764428
(2S)-N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)-2-methylpiperazine-1-carbothioamide;(2R)-4-(3-chloro-2-pyridinyl)-N-[4-chloro-3-(trifluoromethyl)phenyl]-2-methylpiperazine-1-carboxamide;(2S)-4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-propan-2-ylphenyl)piperazine-1-carbothioamide;(2R)-4-(3-chloro-2-pyridinyl)-2-methyl-N-[5-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;(2R)-4-(3-chloro-2-pyridinyl)-2-methyl-N-[6-(trifluoromethyl)-3-pyridinyl]piperazine-1-carboxamide;4-(3-methyl-2-pyridinyl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide
CID 160888615
2-tert-butyl-N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)piperazine-1-carboxamide;2-tert-butyl-4-(3-chloro-2-pyridinyl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;2-tert-butyl-4-(3-chloro-2-pyridinyl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-ethyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-2-ethyl-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide;(2R)-4-(3-fluoro-2-pyridinyl)-2-methyl-N-[4-(3,3,3-trifluoroprop-1-en-2-yl)phenyl]piperazine-1-carboxamide
CID 160999175
N-(4-tert-butylphenyl)-4-(3-chloro-2-pyridinyl)piperazine-1-carboxamide;(2S)-4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-[3-chloro-5-(trifluoromethyl)-2-pyridinyl]-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3,5-dichloro-2-pyridinyl)-N-(4-propan-2-ylphenyl)piperazine-1-carboxamide;4-(3,5-dichloro-2-pyridinyl)-N-[4-(trifluoromethyl)phenyl]piperazine-1-carboxamide
CID 161034446
(2R)-4-(3-chloro-2-pyridinyl)-2-methyl-N-(3-methylphenyl)piperazine-1-carboxamide;(2R)-4-(3-chloro-2-pyridinyl)-2-methyl-N-(4-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(3-methylphenyl)piperazine-1-carboxamide;4-(3-chloro-2-pyridinyl)-N-(4-methylphenyl)piperazine-1-carboxamide;(2R)-2-methyl-N-(3-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;(2R)-2-methyl-N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide;N-(4-methylphenyl)-4-[3-(trifluoromethyl)-2-pyridinyl]piperazine-1-carboxamide
CID 161078255

Frequently Asked Questions

What is the IUPAC name of N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide?
The IUPAC name of N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide (CID 159865253) is N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide.
What is the SMILES notation for N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide?
The canonical SMILES for N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide is CC1CCC(NC(=O)C(=O)N2CCC(c3ccnc4ccccc34)CC2)CC1.Cc1ccc2c(C3CCN(C(=O)C(=O)Nc4ccc(Cl)cc4)CC3)ccnc2c1.O=C(Nc1ccc(CCCl)cc1)C(=O)N1CCC(c2ccnc3ccc(F)cc23)CC1.O=C(Nc1ccc(Cl)cc1)C(=O)N1CCC(c2ccnc3ccc(Cl)cc23)CC1.O=C(Nc1ccc(Cl)cc1)C(=O)N1CCC(c2ccnc3ccc(F)cc23)C(F)(F)C1.O=C(Nc1ccc(Cl)cn1)C(=O)N1CCC(c2ccnc3ccc(F)cc23)CC1.O=C(Nc1ccc(Cl)cn1)C(=O)N1CCC(c2ccnc3ccccc23)CC1.
What is the InChIKey of N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide?
The InChIKey is NRQOKENYLKDVAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H23ClFN3O2.C23H22ClN3O2.C23H29N3O2.C22H19Cl2N3O2.C22H17ClF3N3O2.C21H18ClFN4O2.C21H19ClN4O2/c25-11-7-16-1-4-19(5-2-16)28-23(30)24(31)29-13-9-17(10-14-29)20-8-12-27-22-6-3-18(26)15-21(20)22;1-15-2-7-20-19(8-11-25-21(20)14-15)16-9-12-27(13-10-16)23(29)22(28)26-18-5-3-17(24)4-6-18;1-16-6-8-18(9-7-16)25-22(27)23(28)26-14-11-17(12-15-26)19-10-13-24-21-5-3-2-4-20(19)21;23-15-1-4-17(5-2-15)26-21(28)22(29)27-11-8-14(9-12-27)18-7-10-25-20-6-3-16(24)13-19(18)20;23-13-1-4-15(5-2-13)28-20(30)21(31)29-10-8-18(22(25,26)12-29)16-7-9-27-19-6-3-14(24)11-17(16)19;22-14-1-4-19(25-12-14)26-20(28)21(29)27-9-6-13(7-10-27)16-5-8-24-18-3-2-15(23)11-17(16)18;22-15-5-6-19(24-13-15)25-20(27)21(28)26-11-8-14(9-12-26)16-7-10-23-18-4-2-1-3-17(16)18/h1-6,8,12,15,17H,7,9-11,13-14H2,(H,28,30);2-8,11,14,16H,9-10,12-13H2,1H3,(H,26,28);2-5,10,13,16-18H,6-9,11-12,14-15H2,1H3,(H,25,27);1-7,10,13-14H,8-9,11-12H2,(H,26,28);1-7,9,11,18H,8,10,12H2,(H,28,30);1-5,8,11-13H,6-7,9-10H2,(H,25,26,28);1-7,10,13-14H,8-9,11-12H2,(H,24,25,27).
What are the key properties of N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide?
N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide has a molecular weight of 2911.20 g/mol, XLogP of 29.58, 16 rotatable bonds, 7 hydrogen bond donors, and 23 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-chloroethyl)phenyl]-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(6-chloroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[3,3-difluoro-4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(4-chlorophenyl)-2-[4-(7-methylquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-[4-(6-fluoroquinolin-4-yl)piperidin-1-yl]-2-oxoacetamide;N-(5-chloro-2-pyridinyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide;N-(4-methylcyclohexyl)-2-oxo-2-(4-quinolin-4-ylpiperidin-1-yl)acetamide is sourced from PubChem (CID 159865253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).