4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide

C218H278Cl4F3N35O18 — CID 157440786

IUPAC4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide
SMILESCCN(c1ccc(C(=O)NCCCCCCC(=O)NC)cc1)c1c(Cl)cccc1Cl.CCN(c1ccc(C(=O)NCCCCCCC(=O)NC)cc1)c1ccccc1C(F)(F)F.CNC(=O)CCCCCCN(C)C(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1.CNC(=O)CCCCCCN(C)C(=O)c1ccc(N(c2ncccn2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ccccc2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(Nc2c(C(C)C)cccc2C(C)C)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(Nc2c(C)cccc2C)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(Nc2c(Cl)cccc2Cl)cc1.CNC(=O)CCCCCCNC(=O)c1cnc(N(C)c2ccccc2C(C)C)nc1
InChIInChI=1S/C28H33N3O2.C27H39N3O2.C25H29N5O2.C24H30F3N3O2.C24H29N7O2.C23H29Cl2N3O2.C23H33N5O2.C23H31N3O2.C21H25Cl2N3O2/c1-29-27(32)17-11-3-4-12-22-30(2)28(33)23-18-20-26(21-19-23)31(24-13-7-5-8-14-24)25-15-9-6-10-16-25;1-19(2)23-11-10-12-24(20(3)4)26(23)30-22-16-14-21(15-17-22)27(32)29-18-9-7-6-8-13-25(31)28-5;1-26-23(31)12-7-2-3-8-17-27-24(32)20-13-15-22(16-14-20)30(21-10-5-4-6-11-21)25-28-18-9-19-29-25;1-3-30(21-11-8-7-10-20(21)24(25,26)27)19-15-13-18(14-16-19)23(32)29-17-9-5-4-6-12-22(31)28-2;1-25-21(32)9-5-3-4-6-18-30(2)22(33)19-10-12-20(13-11-19)31(23-26-14-7-15-27-23)24-28-16-8-17-29-24;1-3-28(22-19(24)9-8-10-20(22)25)18-14-12-17(13-15-18)23(30)27-16-7-5-4-6-11-21(29)26-2;1-17(2)19-11-8-9-12-20(19)28(4)23-26-15-18(16-27-23)22(30)25-14-10-6-5-7-13-21(29)24-3;1-17-9-8-10-18(2)22(17)26-20-14-12-19(13-15-20)23(28)25-16-7-5-4-6-11-21(27)24-3;1-24-19(27)9-4-2-3-5-14-25-21(28)15-10-12-16(13-11-15)26-20-17(22)7-6-8-18(20)23/h5-10,13-16,18-21H,3-4,11-12,17,22H2,1-2H3,(H,29,32);10-12,14-17,19-20,30H,6-9,13,18H2,1-5H3,(H,28,31)(H,29,32);4-6,9-11,13-16,18-19H,2-3,7-8,12,17H2,1H3,(H,26,31)(H,27,32);7-8,10-11,13-16H,3-6,9,12,17H2,1-2H3,(H,28,31)(H,29,32);7-8,10-17H,3-6,9,18H2,1-2H3,(H,25,32);8-10,12-15H,3-7,11,16H2,1-2H3,(H,26,29)(H,27,30);8-9,11-12,15-17H,5-7,10,13-14H2,1-4H3,(H,24,29)(H,25,30);8-10,12-15,26H,4-7,11,16H2,1-3H3,(H,24,27)(H,25,28);6-8,10-13,26H,2-5,9,14H2,1H3,(H,24,27)(H,25,28)
InChIKeyBRQLLEINQBZOOX-UHFFFAOYSA-N
MW3875.65 g/mol
LogP44.20
Rot. Bonds98

About 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide

4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide (PubChem CID 157440786) has the molecular formula C218H278Cl4F3N35O18 and a molecular weight of 3875.65 g/mol. Its IUPAC name is 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide.

Molecular Properties

Compound Name4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide
PubChem CID157440786
Molecular FormulaC218H278Cl4F3N35O18
Molecular Weight3875.65 g/mol
Exact Mass3871.06
IUPAC Name4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide
SMILESCCN(c1ccc(C(=O)NCCCCCCC(=O)NC)cc1)c1c(Cl)cccc1Cl.CCN(c1ccc(C(=O)NCCCCCCC(=O)NC)cc1)c1ccccc1C(F)(F)F.CNC(=O)CCCCCCN(C)C(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1.CNC(=O)CCCCCCN(C)C(=O)c1ccc(N(c2ncccn2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ccccc2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(Nc2c(C(C)C)cccc2C(C)C)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(Nc2c(C)cccc2C)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(Nc2c(Cl)cccc2Cl)cc1.CNC(=O)CCCCCCNC(=O)c1cnc(N(C)c2ccccc2C(C)C)nc1
InChIInChI=1S/C28H33N3O2.C27H39N3O2.C25H29N5O2.C24H30F3N3O2.C24H29N7O2.C23H29Cl2N3O2.C23H33N5O2.C23H31N3O2.C21H25Cl2N3O2/c1-29-27(32)17-11-3-4-12-22-30(2)28(33)23-18-20-26(21-19-23)31(24-13-7-5-8-14-24)25-15-9-6-10-16-25;1-19(2)23-11-10-12-24(20(3)4)26(23)30-22-16-14-21(15-17-22)27(32)29-18-9-7-6-8-13-25(31)28-5;1-26-23(31)12-7-2-3-8-17-27-24(32)20-13-15-22(16-14-20)30(21-10-5-4-6-11-21)25-28-18-9-19-29-25;1-3-30(21-11-8-7-10-20(21)24(25,26)27)19-15-13-18(14-16-19)23(32)29-17-9-5-4-6-12-22(31)28-2;1-25-21(32)9-5-3-4-6-18-30(2)22(33)19-10-12-20(13-11-19)31(23-26-14-7-15-27-23)24-28-16-8-17-29-24;1-3-28(22-19(24)9-8-10-20(22)25)18-14-12-17(13-15-18)23(30)27-16-7-5-4-6-11-21(29)26-2;1-17(2)19-11-8-9-12-20(19)28(4)23-26-15-18(16-27-23)22(30)25-14-10-6-5-7-13-21(29)24-3;1-17-9-8-10-18(2)22(17)26-20-14-12-19(13-15-20)23(28)25-16-7-5-4-6-11-21(27)24-3;1-24-19(27)9-4-2-3-5-14-25-21(28)15-10-12-16(13-11-15)26-20-17(22)7-6-8-18(20)23/h5-10,13-16,18-21H,3-4,11-12,17,22H2,1-2H3,(H,29,32);10-12,14-17,19-20,30H,6-9,13,18H2,1-5H3,(H,28,31)(H,29,32);4-6,9-11,13-16,18-19H,2-3,7-8,12,17H2,1H3,(H,26,31)(H,27,32);7-8,10-11,13-16H,3-6,9,12,17H2,1-2H3,(H,28,31)(H,29,32);7-8,10-17H,3-6,9,18H2,1-2H3,(H,25,32);8-10,12-15H,3-7,11,16H2,1-2H3,(H,26,29)(H,27,30);8-9,11-12,15-17H,5-7,10,13-14H2,1-4H3,(H,24,29)(H,25,30);8-10,12-15,26H,4-7,11,16H2,1-3H3,(H,24,27)(H,25,28);6-8,10-13,26H,2-5,9,14H2,1H3,(H,24,27)(H,25,28)
InChIKeyBRQLLEINQBZOOX-UHFFFAOYSA-N
XLogP44.20
TPSA664.87 Ų
H-Bond Donors19
H-Bond Acceptors35
Rotatable Bonds98
Heavy Atoms278
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003875.65
LogP ≤ 544.20
H-Bond Donors ≤ 519
H-Bond Acceptors ≤ 1035

Computed Properties (RDKit)

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

Analyze 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide with MolForge

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Related Compounds

N-[[N-[4-(3-chloro-4-fluoroanilino)-5-methylpyrimidin-2-yl]-4-[(4-methylpiperazin-1-yl)methyl]anilino]methyl]-N-methyl-2-[[2-[4-[(4-methylpiperazin-1-yl)methyl]anilino]-5-(trifluoromethyl)pyrimidin-4-yl]amino]benzamide
CID 144453153
2-[[2-chloro-5-(trifluoromethyl)-4-pyridinyl]amino]-N-methylbenzamide;bis(N-methyl-2-[[2-[(3-methyl-2-pyridinyl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide);3-methylpyridin-2-amine
CID 157235212
N,N-dimethyl-6-[[4-[2-(methylcarbamoyl)anilino]-5-(trifluoromethyl)-2-pyridinyl]amino]pyridine-3-carboxamide;3-methyl-4-[[4-[2-(methylcarbamoyl)anilino]-5-(trifluoromethyl)-2-pyridinyl]amino]-N-propylbenzamide;N-methyl-2-[[2-(2-methyl-4-piperidin-1-ylanilino)-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;N-methyl-2-[[2-[(3-methyl-2-pyridinyl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide;N,N,3-trimethyl-4-[[4-[2-(methylcarbamoyl)anilino]-5-(trifluoromethyl)-2-pyridinyl]amino]benzamide
CID 157318618
4-[[4-[[(1S,2S)-2-(2,2-difluoroethylcarbamoyl)cyclohexyl]methyl]-5-(trifluoromethyl)pyrimidin-2-yl]amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;4-[[4-[[(1S,2S)-2-(dimethylcarbamoyl)cyclohexyl]methyl]-5-(trifluoromethyl)pyrimidin-2-yl]amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;4-[[4-[[(1S,2S)-2-(ethylcarbamoyl)cyclohexyl]methyl]-5-(trifluoromethyl)pyrimidin-2-yl]amino]-N-methyl-N-(1-methylpiperidin-4-yl)benzamide;N-methyl-N-(1-methylpiperidin-4-yl)-4-[[4-[[(1S,2S)-2-(piperidine-1-carbonyl)cyclohexyl]methyl]-5-(trifluoromethyl)pyrimidin-2-yl]amino]benzamide
CID 157343810
4-(2,6-dichloro-N-methylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-(8-oxodecyl)benzamide;4-(4-methoxy-N-(4-methoxyphenyl)anilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-[N-methyl-2,6-di(propan-2-yl)anilino]benzamide;N-[7-(methylamino)-7-oxoheptyl]-4-[N-methyl-2-(trifluoromethyl)anilino]benzamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide
CID 157406753
5-benzyl-3-methyl-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione;5-[(3-chloro-2-pyridinyl)methyl]-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione;5-[(2-methyl-4-pyridinyl)methyl]-6-(4-phenylcyclohexyl)-1H-pyrimidine-2,4-dione;6-(4-phenylcyclohexyl)-5-(pyrimidin-2-ylmethyl)-1H-pyrimidine-2,4-dione;6-(4-phenylcyclohexyl)-5-[[6-(trifluoromethyl)-2-pyridinyl]methyl]-1H-pyrimidine-2,4-dione
CID 157436201
6-amino-1-methyl-3,4-dihydroquinolin-2-one;2-[[2-chloro-5-(trifluoromethyl)-4-pyridinyl]amino]-N,N-dimethylbenzamide;bis(N,N-dimethyl-2-[[2-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide);methane
CID 157594163
6-amino-N-[2-(diethylamino)ethyl]pyridine-3-carboxamide;2-[[2-chloro-5-(trifluoromethyl)-4-pyridinyl]amino]-N-methylbenzamide;bis(N-[2-(diethylamino)ethyl]-6-[[4-[2-(methylcarbamoyl)anilino]-5-(trifluoromethyl)-2-pyridinyl]amino]pyridine-3-carboxamide)
CID 157595965
1-(2,4-Dichlorophenyl)-3-[3-(1,7-dimethyl-2-oxo-1,6-naphthyridin-3-yl)-4-methylphenyl]urea;1-[3-[7-(dimethylamino)-1-methyl-2-oxo-1,6-naphthyridin-3-yl]-4-methylphenyl]-3-phenylurea;1-[3-(1,7-dimethyl-2-oxo-1,6-naphthyridin-3-yl)-4-methylphenyl]-3-[3-fluoro-5-(trifluoromethyl)phenyl]urea;1-[3-(1,7-dimethyl-2-oxo-1,6-naphthyridin-3-yl)-4-methylphenyl]-3-[3-(trifluoromethyl)phenyl]urea
CID 157618797
6-amino-1-methyl-3,4-dihydroquinolin-2-one;2-[[2-chloro-5-(trifluoromethyl)-4-pyridinyl]amino]-N,N-dimethylbenzamide;bis(N,N-dimethyl-2-[[2-[(6-oxo-7,8-dihydro-5H-naphthalen-2-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide)
CID 157631140
6-amino-1-methyl-3,4-dihydroquinolin-2-one;2-[[2-chloro-5-(trifluoromethyl)-4-pyridinyl]amino]-N-methylbenzamide;bis(N-methyl-2-[[2-[(1-methyl-2-oxo-3,4-dihydroquinolin-6-yl)amino]-5-(trifluoromethyl)-4-pyridinyl]amino]benzamide)
CID 157670851
2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]-N-methylpyrimidine-5-carboxamide;2-amino-4-[[(1S)-1-(8-chloro-1-oxo-2-phenylisoquinolin-3-yl)ethyl]amino]pyrimidine-5-carboxamide;3-[(1S)-1-[(2-amino-5-chloropyrimidin-4-yl)amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one;3-[(1S)-1-[[4-amino-5-(trifluoromethyl)-2-pyridinyl]amino]ethyl]-8-chloro-2-phenylisoquinolin-1-one
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Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide?
The IUPAC name of 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide (CID 157440786) is 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide.
What is the SMILES notation for 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide?
The canonical SMILES for 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide is CCN(c1ccc(C(=O)NCCCCCCC(=O)NC)cc1)c1c(Cl)cccc1Cl.CCN(c1ccc(C(=O)NCCCCCCC(=O)NC)cc1)c1ccccc1C(F)(F)F.CNC(=O)CCCCCCN(C)C(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1.CNC(=O)CCCCCCN(C)C(=O)c1ccc(N(c2ncccn2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ccccc2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(Nc2c(C(C)C)cccc2C(C)C)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(Nc2c(C)cccc2C)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(Nc2c(Cl)cccc2Cl)cc1.CNC(=O)CCCCCCNC(=O)c1cnc(N(C)c2ccccc2C(C)C)nc1.
What is the InChIKey of 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide?
The InChIKey is BRQLLEINQBZOOX-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H33N3O2.C27H39N3O2.C25H29N5O2.C24H30F3N3O2.C24H29N7O2.C23H29Cl2N3O2.C23H33N5O2.C23H31N3O2.C21H25Cl2N3O2/c1-29-27(32)17-11-3-4-12-22-30(2)28(33)23-18-20-26(21-19-23)31(24-13-7-5-8-14-24)25-15-9-6-10-16-25;1-19(2)23-11-10-12-24(20(3)4)26(23)30-22-16-14-21(15-17-22)27(32)29-18-9-7-6-8-13-25(31)28-5;1-26-23(31)12-7-2-3-8-17-27-24(32)20-13-15-22(16-14-20)30(21-10-5-4-6-11-21)25-28-18-9-19-29-25;1-3-30(21-11-8-7-10-20(21)24(25,26)27)19-15-13-18(14-16-19)23(32)29-17-9-5-4-6-12-22(31)28-2;1-25-21(32)9-5-3-4-6-18-30(2)22(33)19-10-12-20(13-11-19)31(23-26-14-7-15-27-23)24-28-16-8-17-29-24;1-3-28(22-19(24)9-8-10-20(22)25)18-14-12-17(13-15-18)23(30)27-16-7-5-4-6-11-21(29)26-2;1-17(2)19-11-8-9-12-20(19)28(4)23-26-15-18(16-27-23)22(30)25-14-10-6-5-7-13-21(29)24-3;1-17-9-8-10-18(2)22(17)26-20-14-12-19(13-15-20)23(28)25-16-7-5-4-6-11-21(27)24-3;1-24-19(27)9-4-2-3-5-14-25-21(28)15-10-12-16(13-11-15)26-20-17(22)7-6-8-18(20)23/h5-10,13-16,18-21H,3-4,11-12,17,22H2,1-2H3,(H,29,32);10-12,14-17,19-20,30H,6-9,13,18H2,1-5H3,(H,28,31)(H,29,32);4-6,9-11,13-16,18-19H,2-3,7-8,12,17H2,1H3,(H,26,31)(H,27,32);7-8,10-11,13-16H,3-6,9,12,17H2,1-2H3,(H,28,31)(H,29,32);7-8,10-17H,3-6,9,18H2,1-2H3,(H,25,32);8-10,12-15H,3-7,11,16H2,1-2H3,(H,26,29)(H,27,30);8-9,11-12,15-17H,5-7,10,13-14H2,1-4H3,(H,24,29)(H,25,30);8-10,12-15,26H,4-7,11,16H2,1-3H3,(H,24,27)(H,25,28);6-8,10-13,26H,2-5,9,14H2,1H3,(H,24,27)(H,25,28).
What are the key properties of 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide?
4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide has a molecular weight of 3875.65 g/mol, XLogP of 44.20, 98 rotatable bonds, 19 hydrogen bond donors, and 35 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dichloroanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dichloro-N-ethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-(2,6-dimethylanilino)-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[2,6-di(propan-2-yl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[di(pyrimidin-2-yl)amino]-N-methyl-N-[7-(methylamino)-7-oxoheptyl]benzamide;4-[N-ethyl-2-(trifluoromethyl)anilino]-N-[7-(methylamino)-7-oxoheptyl]benzamide;N-[7-(methylamino)-7-oxoheptyl]-2-(N-methyl-2-propan-2-ylanilino)pyrimidine-5-carboxamide;N-[7-(methylamino)-7-oxoheptyl]-4-(N-pyrimidin-2-ylanilino)benzamide;N-methyl-N-[7-(methylamino)-7-oxoheptyl]-4-(N-phenylanilino)benzamide is sourced from PubChem (CID 157440786), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).