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

C197H246Cl2F3N33O18 — CID 157406753

IUPAC4-(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
SMILESCCC(=O)CCCCCCCNC(=O)c1ccc(N(c2ncccn2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(C)c2c(C(C)C)cccc2C(C)C)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(C)c2c(Cl)cccc2Cl)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(C)c2ccccc2C(F)(F)F)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ncccn2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1cnc(N(C)c2ccccc2)nc1
InChIInChI=1S/C29H35N3O4.C28H41N3O2.C27H31N3O2.C25H30N6O2.C23H28F3N3O2.C23H27N7O2.C22H27Cl2N3O2.C20H27N5O2/c1-30-28(33)8-6-4-5-7-21-31-29(34)22-9-11-23(12-10-22)32(24-13-17-26(35-2)18-14-24)25-15-19-27(36-3)20-16-25;1-20(2)24-12-11-13-25(21(3)4)27(24)31(6)23-17-15-22(16-18-23)28(33)30-19-10-8-7-9-14-26(32)29-5;1-28-26(31)16-10-2-3-11-21-29-27(32)22-17-19-25(20-18-22)30(23-12-6-4-7-13-23)24-14-8-5-9-15-24;1-2-22(32)10-6-4-3-5-7-15-26-23(33)20-11-13-21(14-12-20)31(24-27-16-8-17-28-24)25-29-18-9-19-30-25;1-27-21(30)11-5-3-4-8-16-28-22(31)17-12-14-18(15-13-17)29(2)20-10-7-6-9-19(20)23(24,25)26;1-24-20(31)8-4-2-3-5-13-25-21(32)18-9-11-19(12-10-18)30(22-26-14-6-15-27-22)23-28-16-7-17-29-23;1-25-20(28)10-5-3-4-6-15-26-22(29)16-11-13-17(14-12-16)27(2)21-18(23)8-7-9-19(21)24;1-21-18(26)12-8-3-4-9-13-22-19(27)16-14-23-20(24-15-16)25(2)17-10-6-5-7-11-17/h9-20H,4-8,21H2,1-3H3,(H,30,33)(H,31,34);11-13,15-18,20-21H,7-10,14,19H2,1-6H3,(H,29,32)(H,30,33);4-9,12-15,17-20H,2-3,10-11,16,21H2,1H3,(H,28,31)(H,29,32);8-9,11-14,16-19H,2-7,10,15H2,1H3,(H,26,33);6-7,9-10,12-15H,3-5,8,11,16H2,1-2H3,(H,27,30)(H,28,31);6-7,9-12,14-17H,2-5,8,13H2,1H3,(H,24,31)(H,25,32);7-9,11-14H,3-6,10,15H2,1-2H3,(H,25,28)(H,26,29);5-7,10-11,14-15H,3-4,8-9,12-13H2,1-2H3,(H,21,26)(H,22,27)
InChIKeyBNUPHHCPDVERIJ-UHFFFAOYSA-N
MW3492.25 g/mol
LogP38.02
Rot. Bonds90

About 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

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 (PubChem CID 157406753) has the molecular formula C197H246Cl2F3N33O18 and a molecular weight of 3492.25 g/mol. Its IUPAC name is 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.

Molecular Properties

Compound Name4-(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
PubChem CID157406753
Molecular FormulaC197H246Cl2F3N33O18
Molecular Weight3492.25 g/mol
Exact Mass3488.87
IUPAC Name4-(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
SMILESCCC(=O)CCCCCCCNC(=O)c1ccc(N(c2ncccn2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(C)c2c(C(C)C)cccc2C(C)C)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(C)c2c(Cl)cccc2Cl)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(C)c2ccccc2C(F)(F)F)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ncccn2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1cnc(N(C)c2ccccc2)nc1
InChIInChI=1S/C29H35N3O4.C28H41N3O2.C27H31N3O2.C25H30N6O2.C23H28F3N3O2.C23H27N7O2.C22H27Cl2N3O2.C20H27N5O2/c1-30-28(33)8-6-4-5-7-21-31-29(34)22-9-11-23(12-10-22)32(24-13-17-26(35-2)18-14-24)25-15-19-27(36-3)20-16-25;1-20(2)24-12-11-13-25(21(3)4)27(24)31(6)23-17-15-22(16-18-23)28(33)30-19-10-8-7-9-14-26(32)29-5;1-28-26(31)16-10-2-3-11-21-29-27(32)22-17-19-25(20-18-22)30(23-12-6-4-7-13-23)24-14-8-5-9-15-24;1-2-22(32)10-6-4-3-5-7-15-26-23(33)20-11-13-21(14-12-20)31(24-27-16-8-17-28-24)25-29-18-9-19-30-25;1-27-21(30)11-5-3-4-8-16-28-22(31)17-12-14-18(15-13-17)29(2)20-10-7-6-9-19(20)23(24,25)26;1-24-20(31)8-4-2-3-5-13-25-21(32)18-9-11-19(12-10-18)30(22-26-14-6-15-27-22)23-28-16-7-17-29-23;1-25-20(28)10-5-3-4-6-15-26-22(29)16-11-13-17(14-12-16)27(2)21-18(23)8-7-9-19(21)24;1-21-18(26)12-8-3-4-9-13-22-19(27)16-14-23-20(24-15-16)25(2)17-10-6-5-7-11-17/h9-20H,4-8,21H2,1-3H3,(H,30,33)(H,31,34);11-13,15-18,20-21H,7-10,14,19H2,1-6H3,(H,29,32)(H,30,33);4-9,12-15,17-20H,2-3,10-11,16,21H2,1H3,(H,28,31)(H,29,32);8-9,11-14,16-19H,2-7,10,15H2,1H3,(H,26,33);6-7,9-10,12-15H,3-5,8,11,16H2,1-2H3,(H,27,30)(H,28,31);6-7,9-12,14-17H,2-5,8,13H2,1H3,(H,24,31)(H,25,32);7-9,11-14H,3-6,10,15H2,1-2H3,(H,25,28)(H,26,29);5-7,10-11,14-15H,3-4,8-9,12-13H2,1-2H3,(H,21,26)(H,22,27)
InChIKeyBNUPHHCPDVERIJ-UHFFFAOYSA-N
XLogP38.02
TPSA626.85 Ų
H-Bond Donors15
H-Bond Acceptors36
Rotatable Bonds90
Heavy Atoms253
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5003492.25
LogP ≤ 538.02
H-Bond Donors ≤ 515
H-Bond Acceptors ≤ 1036

Computed Properties (RDKit)

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

Analyze 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 with MolForge

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Related Compounds

1-[2-[[2-[[2-(4-Acetylpiperazin-1-yl)-6-methoxy-4-pyridinyl]amino]-5-chloropyrimidin-4-yl]amino]-5-methoxyphenyl]but-3-en-2-one;1-[5-fluoro-2-[[2-[(2-methoxy-5-methyl-4-pyridinyl)amino]-5-methylpyrimidin-4-yl]amino]phenyl]but-3-en-2-one;1-[2-[[2-[[2-methoxy-6-(4-methylpiperazin-1-yl)-4-pyridinyl]amino]-5-methylpyrimidin-4-yl]amino]phenyl]but-3-en-2-one;1-[2-[[2-[(2-methoxy-5-methyl-4-pyridinyl)amino]-5-methylpyrimidin-4-yl]amino]-5-(trifluoromethyl)phenyl]but-3-en-2-one;1-[2-[[5-methyl-2-[[2-(methylamino)-4-pyridinyl]amino]pyrimidin-4-yl]amino]phenyl]but-3-en-2-one
CID 157121267
N-[4-[chloro(difluoro)methoxy]phenyl]-5-(5-cyano-3-pyridinyl)-6-[2-hydroxyethyl(methyl)amino]pyridine-3-carboxamide;5-(5-cyano-3-pyridinyl)-6-[ethyl(2-hydroxyethyl)amino]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;5-(5-cyano-3-pyridinyl)-6-[2-hydroxyethyl(methyl)amino]-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[ethyl(2-hydroxyethyl)amino]-5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[ethyl(2-hydroxyethyl)amino]-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(2-hydroxyethylamino)-5-pyridin-3-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 157187034
CID 157229239
CID 157229239
2-chloro-4-(2-methylpropyl)pyridine;1-chloro-3-(2-methylpropyl)-5-(trifluoromethoxy)benzene;N'-cyano-2-[3-(2-methylpropyl)phenyl]ethanimidamide;1-cyano-2-[[3-(2-methylpropyl)phenyl]methyl]guanidine;2-isocyano-4-(2-methylpropyl)pyridine;N-methyl-4-(2-methylpropyl)benzamide;4-(2-methylpropyl)aniline;3-(2-methylpropyl)benzamide;[3-(2-methylpropyl)phenyl]methylurea;1-(2-methylpropyl)-4-(trifluoromethoxy)benzene;1-(2-methylpropyl)-3-(trifluoromethyl)benzene;1-(2-methylpropyl)-4-(trifluoromethyl)benzene;2-(2-methylpropyl)-5-(trifluoromethyl)pyridine;2-(2-methylpropyl)-6-(trifluoromethyl)pyridine;4-(2-methylpropyl)-2-(trifluoromethyl)pyrimidine
CID 157231491
N-(2-chloro-6-fluorophenyl)-6-methoxy-2-phenylquinazolin-4-amine;N-(2-chloro-5-methoxyphenyl)-6-methoxy-2-phenylquinazolin-4-amine;N-(2-chloro-4-methylphenyl)-6-methoxy-2-pyridin-3-ylquinazolin-4-amine;N-(3,3-difluorobutyl)-2-[(6-methoxy-2-pyridin-3-ylquinazolin-4-yl)amino]benzamide;N-(3,4-dimethylphenyl)-6-methoxy-2-phenylquinazolin-4-amine;methane
CID 157278480
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
5-(6-chloro-5-fluoro-3-pyridinyl)-6-(3,3-dimethylazetidin-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;5-(6-chloro-5-fluoro-3-pyridinyl)-6-(3-ethylazetidin-1-yl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-ethylazetidin-1-yl)-5-(5-fluoro-6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-ethylazetidin-1-yl)-5-(5-fluoro-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-ethylazetidin-1-yl)-5-(6-methyl-3-pyridinyl)-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3-ethylazetidin-1-yl)-5-pyridin-3-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
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N-[4-[chloro(difluoro)methoxy]phenyl]-6-[(3R)-3-methylpiperidin-1-yl]-5-pyrimidin-5-ylpyridine-3-carboxamide;6-[(3S)-3-ethynylpiperidin-1-yl]-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-[(3R)-3-ethynylpiperidin-1-yl]-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(4-methylpiperidin-1-yl)-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
CID 157933092
6-chloro-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(1-cyanocyclobutyl)-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(4-cyanooxan-4-yl)-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(2-cyanopropan-2-yl)-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(3,6-dihydro-2H-pyran-4-yl)-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-methyl-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;6-(oxan-4-yl)-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide;5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]-6-(trifluoromethyl)pyridine-3-carboxamide
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N-[4-[chloro(difluoro)methoxy]phenyl]-6-(3-fluoro-3-methylpyrrolidin-1-yl)-5-pyrimidin-5-ylpyridine-3-carboxamide;4-(3,3-dimethylpyrrolidin-1-yl)-3-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]benzamide;tris(6-(3,3-dimethylpyrrolidin-1-yl)-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide);6-(3-fluoro-3-methylpyrrolidin-1-yl)-5-pyrimidin-5-yl-N-[4-(trifluoromethoxy)phenyl]pyridine-3-carboxamide
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Frequently Asked Questions

What is the IUPAC name of 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?
The IUPAC name of 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) is 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.
What is the SMILES notation for 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?
The canonical SMILES for 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 is CCC(=O)CCCCCCCNC(=O)c1ccc(N(c2ncccn2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(C)c2c(C(C)C)cccc2C(C)C)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(C)c2c(Cl)cccc2Cl)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(C)c2ccccc2C(F)(F)F)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ccc(OC)cc2)c2ccc(OC)cc2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ccccc2)c2ccccc2)cc1.CNC(=O)CCCCCCNC(=O)c1ccc(N(c2ncccn2)c2ncccn2)cc1.CNC(=O)CCCCCCNC(=O)c1cnc(N(C)c2ccccc2)nc1.
What is the InChIKey of 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?
The InChIKey is BNUPHHCPDVERIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H35N3O4.C28H41N3O2.C27H31N3O2.C25H30N6O2.C23H28F3N3O2.C23H27N7O2.C22H27Cl2N3O2.C20H27N5O2/c1-30-28(33)8-6-4-5-7-21-31-29(34)22-9-11-23(12-10-22)32(24-13-17-26(35-2)18-14-24)25-15-19-27(36-3)20-16-25;1-20(2)24-12-11-13-25(21(3)4)27(24)31(6)23-17-15-22(16-18-23)28(33)30-19-10-8-7-9-14-26(32)29-5;1-28-26(31)16-10-2-3-11-21-29-27(32)22-17-19-25(20-18-22)30(23-12-6-4-7-13-23)24-14-8-5-9-15-24;1-2-22(32)10-6-4-3-5-7-15-26-23(33)20-11-13-21(14-12-20)31(24-27-16-8-17-28-24)25-29-18-9-19-30-25;1-27-21(30)11-5-3-4-8-16-28-22(31)17-12-14-18(15-13-17)29(2)20-10-7-6-9-19(20)23(24,25)26;1-24-20(31)8-4-2-3-5-13-25-21(32)18-9-11-19(12-10-18)30(22-26-14-6-15-27-22)23-28-16-7-17-29-23;1-25-20(28)10-5-3-4-6-15-26-22(29)16-11-13-17(14-12-16)27(2)21-18(23)8-7-9-19(21)24;1-21-18(26)12-8-3-4-9-13-22-19(27)16-14-23-20(24-15-16)25(2)17-10-6-5-7-11-17/h9-20H,4-8,21H2,1-3H3,(H,30,33)(H,31,34);11-13,15-18,20-21H,7-10,14,19H2,1-6H3,(H,29,32)(H,30,33);4-9,12-15,17-20H,2-3,10-11,16,21H2,1H3,(H,28,31)(H,29,32);8-9,11-14,16-19H,2-7,10,15H2,1H3,(H,26,33);6-7,9-10,12-15H,3-5,8,11,16H2,1-2H3,(H,27,30)(H,28,31);6-7,9-12,14-17H,2-5,8,13H2,1H3,(H,24,31)(H,25,32);7-9,11-14H,3-6,10,15H2,1-2H3,(H,25,28)(H,26,29);5-7,10-11,14-15H,3-4,8-9,12-13H2,1-2H3,(H,21,26)(H,22,27).
What are the key properties of 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?
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 has a molecular weight of 3492.25 g/mol, XLogP of 38.02, 90 rotatable bonds, 15 hydrogen bond donors, and 36 hydrogen bond acceptors.
Where does this data come from?
All data for 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 is sourced from PubChem (CID 157406753), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).