4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one

C163H176N20O18 — CID 158064411

About 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one

4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one (PubChem CID 158064411) has the molecular formula C163H176N20O18 and a molecular weight of 2703.32 g/mol. Its IUPAC name is 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one.

Molecular Properties

• Compound Name: 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one
• PubChem CID: 158064411
• Molecular Formula: C163H176N20O18
• Molecular Weight: 2703.32 g/mol
• Exact Mass: 2701.35
• IUPAC Name: 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one
• SMILES: CC(C)(C)C(=O)c1ccc2[nH]c(-c3cccc(OCCO)c3)cc2c1.CC(C)(C)C(=O)c1ccc2nc(-c3ccc(NC(=O)c4cn(CCOCCO)nn4)cc3)[nH]c2c1.CN(C)CCOc1ccc(-c2cc3ccc(C(=O)C(C)(C)C)cc3[nH]2)cc1.COc1ccc(-c2nc3ccc(C(=O)C(C)(C)C)cc3[nH]2)cc1O.Cc1ccc(NC(=O)c2cc3cc(C(=O)C(C)(C)C)ccc3n2C)cc1.Cn1c(-c2ccc(NC(=O)c3ccc(N)cc3)cc2)cc2cc(C(=O)C(C)(C)C)ccc21.Cn1c(-c2ccc(NC(=O)c3ccc(N)cc3)cc2)nc2cc(C(=O)C(C)(C)C)ccc21
• InChI: InChI=1S/C27H27N3O2.C26H26N4O2.C25H28N6O4.C23H28N2O2.C22H24N2O2.C21H23NO3.C19H20N2O3/c1-27(2,3)25(31)19-9-14-23-20(15-19)16-24(30(23)4)17-7-12-22(13-8-17)29-26(32)18-5-10-21(28)11-6-18;1-26(2,3)23(31)18-9-14-22-21(15-18)29-24(30(22)4)16-7-12-20(13-8-16)28-25(32)17-5-10-19(27)11-6-17;1-25(2,3)22(33)17-6-9-19-20(14-17)28-23(27-19)16-4-7-18(8-5-16)26-24(34)21-15-31(30-29-21)10-12-35-13-11-32;1-23(2,3)22(26)18-7-6-17-14-20(24-21(17)15-18)16-8-10-19(11-9-16)27-13-12-25(4)5;1-14-6-9-17(10-7-14)23-21(26)19-13-16-12-15(20(25)22(2,3)4)8-11-18(16)24(19)5;1-21(2,3)20(24)15-7-8-18-16(11-15)13-19(22-18)14-5-4-6-17(12-14)25-10-9-23;1-19(2,3)17(23)11-5-7-13-14(9-11)21-18(20-13)12-6-8-16(24-4)15(22)10-12/h5-16H,28H2,1-4H3,(H,29,32);5-15H,27H2,1-4H3,(H,28,32);4-9,14-15,32H,10-13H2,1-3H3,(H,26,34)(H,27,28);6-11,14-15,24H,12-13H2,1-5H3;6-13H,1-5H3,(H,23,26);4-8,11-13,22-23H,9-10H2,1-3H3;5-10,22H,1-4H3,(H,20,21)
• InChIKey: FLAWOGRYDZVDLH-UHFFFAOYSA-N
• XLogP: 33.10
• TPSA: 536.11 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 30
• Rotatable Bonds: 34
• Heavy Atoms: 201
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2703.32
LogP ≤ 5	33.10
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one?

The IUPAC name of 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one (CID 158064411) is 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one.

What is the SMILES notation for 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one?

The canonical SMILES for 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one is CC(C)(C)C(=O)c1ccc2[nH]c(-c3cccc(OCCO)c3)cc2c1.CC(C)(C)C(=O)c1ccc2nc(-c3ccc(NC(=O)c4cn(CCOCCO)nn4)cc3)[nH]c2c1.CN(C)CCOc1ccc(-c2cc3ccc(C(=O)C(C)(C)C)cc3[nH]2)cc1.COc1ccc(-c2nc3ccc(C(=O)C(C)(C)C)cc3[nH]2)cc1O.Cc1ccc(NC(=O)c2cc3cc(C(=O)C(C)(C)C)ccc3n2C)cc1.Cn1c(-c2ccc(NC(=O)c3ccc(N)cc3)cc2)cc2cc(C(=O)C(C)(C)C)ccc21.Cn1c(-c2ccc(NC(=O)c3ccc(N)cc3)cc2)nc2cc(C(=O)C(C)(C)C)ccc21.

What is the InChIKey of 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one?

The InChIKey is FLAWOGRYDZVDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C27H27N3O2.C26H26N4O2.C25H28N6O4.C23H28N2O2.C22H24N2O2.C21H23NO3.C19H20N2O3/c1-27(2,3)25(31)19-9-14-23-20(15-19)16-24(30(23)4)17-7-12-22(13-8-17)29-26(32)18-5-10-21(28)11-6-18;1-26(2,3)23(31)18-9-14-22-21(15-18)29-24(30(22)4)16-7-12-20(13-8-16)28-25(32)17-5-10-19(27)11-6-17;1-25(2,3)22(33)17-6-9-19-20(14-17)28-23(27-19)16-4-7-18(8-5-16)26-24(34)21-15-31(30-29-21)10-12-35-13-11-32;1-23(2,3)22(26)18-7-6-17-14-20(24-21(17)15-18)16-8-10-19(11-9-16)27-13-12-25(4)5;1-14-6-9-17(10-7-14)23-21(26)19-13-16-12-15(20(25)22(2,3)4)8-11-18(16)24(19)5;1-21(2,3)20(24)15-7-8-18-16(11-15)13-19(22-18)14-5-4-6-17(12-14)25-10-9-23;1-19(2,3)17(23)11-5-7-13-14(9-11)21-18(20-13)12-6-8-16(24-4)15(22)10-12/h5-16H,28H2,1-4H3,(H,29,32);5-15H,27H2,1-4H3,(H,28,32);4-9,14-15,32H,10-13H2,1-3H3,(H,26,34)(H,27,28);6-11,14-15,24H,12-13H2,1-5H3;6-13H,1-5H3,(H,23,26);4-8,11-13,22-23H,9-10H2,1-3H3;5-10,22H,1-4H3,(H,20,21).

What are the key properties of 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one?

4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one has a molecular weight of 2703.32 g/mol, XLogP of 33.10, 34 rotatable bonds, 13 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylbenzimidazol-2-yl]phenyl]benzamide;4-amino-N-[4-[5-(2,2-dimethylpropanoyl)-1-methylindol-2-yl]phenyl]benzamide;1-[2-[4-[2-(dimethylamino)ethoxy]phenyl]-1H-indol-6-yl]-2,2-dimethylpropan-1-one;N-[4-[6-(2,2-dimethylpropanoyl)-1H-benzimidazol-2-yl]phenyl]-1-[2-(2-hydroxyethoxy)ethyl]triazole-4-carboxamide;5-(2,2-dimethylpropanoyl)-1-methyl-N-(4-methylphenyl)indole-2-carboxamide;1-[2-[3-(2-hydroxyethoxy)phenyl]-1H-indol-5-yl]-2,2-dimethylpropan-1-one;1-[2-(3-hydroxy-4-methoxyphenyl)-3H-benzimidazol-5-yl]-2,2-dimethylpropan-1-one is sourced from PubChem (CID 158064411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).