5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide

C169H153BrCl3F3I10N20O14S — CID 173276290

About 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide

5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide (PubChem CID 173276290) has the molecular formula C169H153BrCl3F3I10N20O14S and a molecular weight of 4232.57 g/mol. Its IUPAC name is 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide.

Molecular Properties

• Compound Name: 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide
• PubChem CID: 173276290
• Molecular Formula: C169H153BrCl3F3I10N20O14S
• Molecular Weight: 4232.57 g/mol
• Exact Mass: 4228.02
• IUPAC Name: 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide
• SMILES: C=CCNC(=O)c1cc(Cl)ccc1Nc1ccc(I)cc1C.C=CCNC(=O)c1cc(F)ccc1Nc1ccc(I)cc1C.Cc1cc(I)ccc1Nc1ccc(Br)cc1C(=O)NC1CC1.Cc1cc(I)ccc1Nc1ccc(Cl)cc1C(=O)N(C)c1ccccc1.Cc1cc(I)ccc1Nc1ccc(Cl)cc1C(=O)NC1CC1.Cc1cc(I)ccc1Nc1ccc(F)cc1C(=O)N(C)c1ccccc1.Cc1cc(I)ccc1Nc1ccc(F)cc1C(=O)NCc1ccc(S(N)(=O)=O)cc1.Cc1cc(I)ccc1Nc1ccc(I)cc1C(=O)NOCc1ccccc1.Cc1cc(I)ccc1Nc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1
• InChI: InChI=1S/C21H18ClIN2O.C21H19FIN3O3S.C21H18FIN2O.C21H18I2N2O2.C17H16BrIN2O.2C17H16ClIN2O.C17H16FIN2O.C17H16IN3O3/c1-14-12-16(23)9-11-19(14)24-20-10-8-15(22)13-18(20)21(26)25(2)17-6-4-3-5-7-17;1-13-10-16(23)5-9-19(13)26-20-8-4-15(22)11-18(20)21(27)25-12-14-2-6-17(7-3-14)30(24,28)29;1-14-12-16(23)9-11-19(14)24-20-10-8-15(22)13-18(20)21(26)25(2)17-6-4-3-5-7-17;1-14-11-16(22)7-9-19(14)24-20-10-8-17(23)12-18(20)21(26)25-27-13-15-5-3-2-4-6-15;2*1-10-8-12(19)3-7-15(10)21-16-6-2-11(18)9-14(16)17(22)20-13-4-5-13;2*1-3-8-20-17(22)14-10-12(18)4-6-16(14)21-15-7-5-13(19)9-11(15)2;1-10-8-11(18)2-6-15(10)20-16-7-5-13(21(23)24)9-14(16)17(22)19-12-3-4-12/h3-13,24H,1-2H3;2-11,26H,12H2,1H3,(H,25,27)(H2,24,28,29);3-13,24H,1-2H3;2-12,24H,13H2,1H3,(H,25,26);2*2-3,6-9,13,21H,4-5H2,1H3,(H,20,22);2*3-7,9-10,21H,1,8H2,2H3,(H,20,22);2,5-9,12,20H,3-4H2,1H3,(H,19,22)
• InChIKey: QPBCBOMKGGOKDM-UHFFFAOYSA-N
• XLogP: 45.24
• TPSA: 465.12 Ų
• H-Bond Donors: 17
• H-Bond Acceptors: 23
• Rotatable Bonds: 43
• Heavy Atoms: 221
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	4232.57
LogP ≤ 5	45.24
H-Bond Donors ≤ 5	17
H-Bond Acceptors ≤ 10	23

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide?

The IUPAC name of 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide (CID 173276290) is 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide.

What is the SMILES notation for 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide?

The canonical SMILES for 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide is C=CCNC(=O)c1cc(Cl)ccc1Nc1ccc(I)cc1C.C=CCNC(=O)c1cc(F)ccc1Nc1ccc(I)cc1C.Cc1cc(I)ccc1Nc1ccc(Br)cc1C(=O)NC1CC1.Cc1cc(I)ccc1Nc1ccc(Cl)cc1C(=O)N(C)c1ccccc1.Cc1cc(I)ccc1Nc1ccc(Cl)cc1C(=O)NC1CC1.Cc1cc(I)ccc1Nc1ccc(F)cc1C(=O)N(C)c1ccccc1.Cc1cc(I)ccc1Nc1ccc(F)cc1C(=O)NCc1ccc(S(N)(=O)=O)cc1.Cc1cc(I)ccc1Nc1ccc(I)cc1C(=O)NOCc1ccccc1.Cc1cc(I)ccc1Nc1ccc([N+](=O)[O-])cc1C(=O)NC1CC1.

What is the InChIKey of 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide?

The InChIKey is QPBCBOMKGGOKDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18ClIN2O.C21H19FIN3O3S.C21H18FIN2O.C21H18I2N2O2.C17H16BrIN2O.2C17H16ClIN2O.C17H16FIN2O.C17H16IN3O3/c1-14-12-16(23)9-11-19(14)24-20-10-8-15(22)13-18(20)21(26)25(2)17-6-4-3-5-7-17;1-13-10-16(23)5-9-19(13)26-20-8-4-15(22)11-18(20)21(27)25-12-14-2-6-17(7-3-14)30(24,28)29;1-14-12-16(23)9-11-19(14)24-20-10-8-15(22)13-18(20)21(26)25(2)17-6-4-3-5-7-17;1-14-11-16(22)7-9-19(14)24-20-10-8-17(23)12-18(20)21(26)25-27-13-15-5-3-2-4-6-15;2*1-10-8-12(19)3-7-15(10)21-16-6-2-11(18)9-14(16)17(22)20-13-4-5-13;2*1-3-8-20-17(22)14-10-12(18)4-6-16(14)21-15-7-5-13(19)9-11(15)2;1-10-8-11(18)2-6-15(10)20-16-7-5-13(21(23)24)9-14(16)17(22)19-12-3-4-12/h3-13,24H,1-2H3;2-11,26H,12H2,1H3,(H,25,27)(H2,24,28,29);3-13,24H,1-2H3;2-12,24H,13H2,1H3,(H,25,26);2*2-3,6-9,13,21H,4-5H2,1H3,(H,20,22);2*3-7,9-10,21H,1,8H2,2H3,(H,20,22);2,5-9,12,20H,3-4H2,1H3,(H,19,22).

What are the key properties of 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide?

5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide has a molecular weight of 4232.57 g/mol, XLogP of 45.24, 43 rotatable bonds, 17 hydrogen bond donors, and 23 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-N-cyclopropyl-2-(4-iodo-2-methylanilino)benzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-chloro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;N-cyclopropyl-2-(4-iodo-2-methylanilino)-5-nitrobenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-methyl-N-phenylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-prop-2-enylbenzamide;5-fluoro-2-(4-iodo-2-methylanilino)-N-[(4-sulfamoylphenyl)methyl]benzamide;5-iodo-2-(4-iodo-2-methylanilino)-N-phenylmethoxybenzamide is sourced from PubChem (CID 173276290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).