2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide

C115H102Cl5F5N22O11S7 — CID 159098747

About 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide

2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide (PubChem CID 159098747) has the molecular formula C115H102Cl5F5N22O11S7 and a molecular weight of 2464.95 g/mol. Its IUPAC name is 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide.

Molecular Properties

• Compound Name: 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide
• PubChem CID: 159098747
• Molecular Formula: C115H102Cl5F5N22O11S7
• Molecular Weight: 2464.95 g/mol
• Exact Mass: 2460.45
• IUPAC Name: 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide
• SMILES: COc1cc(NC(=O)CSc2nc3cc(Cl)ncc3[nH]2)ccc1C.Cc1cc2c(cn1)N=C(SCC(=O)Nc1ccc(C)c(F)c1)C2.Cc1cc2c(cn1)N=C(SCC(=O)Nc1ccc(C)c(O)c1)C2.Cc1ccc(NC(=O)CSC2=Nc3cnc(Cl)cc3C2)cc1.Cc1ccc(NC(=O)CSC2=Nc3cnc(Cl)cc3C2)cc1F.Cc1ccc(NC(=O)CSC2=Nc3cnc(Cl)cc3C2)cc1O.Cc1ccc(NC(=O)CSC2=Nc3cnc(Cl)cc3C2)cc1OC(F)(F)F
• InChI: InChI=1S/C17H13ClF3N3O2S.C17H16FN3OS.C17H17N3O2S.C16H13ClFN3OS.C16H15ClN4O2S.C16H14ClN3O2S.C16H14ClN3OS/c1-9-2-3-11(6-13(9)26-17(19,20)21)23-15(25)8-27-16-5-10-4-14(18)22-7-12(10)24-16;1-10-3-4-13(7-14(10)18)20-16(22)9-23-17-6-12-5-11(2)19-8-15(12)21-17;1-10-3-4-13(7-15(10)21)19-16(22)9-23-17-6-12-5-11(2)18-8-14(12)20-17;1-9-2-3-11(6-12(9)18)20-15(22)8-23-16-5-10-4-14(17)19-7-13(10)21-16;1-9-3-4-10(5-13(9)23-2)19-15(22)8-24-16-20-11-6-14(17)18-7-12(11)21-16;1-9-2-3-11(6-13(9)21)19-15(22)8-23-16-5-10-4-14(17)18-7-12(10)20-16;1-10-2-4-12(5-3-10)19-15(21)9-22-16-7-11-6-14(17)18-8-13(11)20-16/h2-4,6-7H,5,8H2,1H3,(H,23,25);3-5,7-8H,6,9H2,1-2H3,(H,20,22);3-5,7-8,21H,6,9H2,1-2H3,(H,19,22);2-4,6-7H,5,8H2,1H3,(H,20,22);3-7H,8H2,1-2H3,(H,19,22)(H,20,21);2-4,6-7,21H,5,8H2,1H3,(H,19,22);2-6,8H,7,9H2,1H3,(H,19,21)
• InChIKey: KCZSOABJMAIRMO-UHFFFAOYSA-N
• XLogP: 27.57
• TPSA: 455.69 Ų
• H-Bond Donors: 10
• H-Bond Acceptors: 32
• Rotatable Bonds: 24
• Heavy Atoms: 165
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2464.95
LogP ≤ 5	27.57
H-Bond Donors ≤ 5	10
H-Bond Acceptors ≤ 10	32

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide?

The IUPAC name of 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide (CID 159098747) is 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide.

What is the SMILES notation for 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide?

The canonical SMILES for 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide is COc1cc(NC(=O)CSc2nc3cc(Cl)ncc3[nH]2)ccc1C.Cc1cc2c(cn1)N=C(SCC(=O)Nc1ccc(C)c(F)c1)C2.Cc1cc2c(cn1)N=C(SCC(=O)Nc1ccc(C)c(O)c1)C2.Cc1ccc(NC(=O)CSC2=Nc3cnc(Cl)cc3C2)cc1.Cc1ccc(NC(=O)CSC2=Nc3cnc(Cl)cc3C2)cc1F.Cc1ccc(NC(=O)CSC2=Nc3cnc(Cl)cc3C2)cc1O.Cc1ccc(NC(=O)CSC2=Nc3cnc(Cl)cc3C2)cc1OC(F)(F)F.

What is the InChIKey of 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide?

The InChIKey is KCZSOABJMAIRMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H13ClF3N3O2S.C17H16FN3OS.C17H17N3O2S.C16H13ClFN3OS.C16H15ClN4O2S.C16H14ClN3O2S.C16H14ClN3OS/c1-9-2-3-11(6-13(9)26-17(19,20)21)23-15(25)8-27-16-5-10-4-14(18)22-7-12(10)24-16;1-10-3-4-13(7-14(10)18)20-16(22)9-23-17-6-12-5-11(2)19-8-15(12)21-17;1-10-3-4-13(7-15(10)21)19-16(22)9-23-17-6-12-5-11(2)18-8-14(12)20-17;1-9-2-3-11(6-12(9)18)20-15(22)8-23-16-5-10-4-14(17)19-7-13(10)21-16;1-9-3-4-10(5-13(9)23-2)19-15(22)8-24-16-20-11-6-14(17)18-7-12(11)21-16;1-9-2-3-11(6-13(9)21)19-15(22)8-23-16-5-10-4-14(17)18-7-12(10)20-16;1-10-2-4-12(5-3-10)19-15(21)9-22-16-7-11-6-14(17)18-8-13(11)20-16/h2-4,6-7H,5,8H2,1H3,(H,23,25);3-5,7-8H,6,9H2,1-2H3,(H,20,22);3-5,7-8,21H,6,9H2,1-2H3,(H,19,22);2-4,6-7H,5,8H2,1H3,(H,20,22);3-7H,8H2,1-2H3,(H,19,22)(H,20,21);2-4,6-7,21H,5,8H2,1H3,(H,19,22);2-6,8H,7,9H2,1H3,(H,19,21).

What are the key properties of 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide?

2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide has a molecular weight of 2464.95 g/mol, XLogP of 27.57, 24 rotatable bonds, 10 hydrogen bond donors, and 32 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(6-chloro-3H-imidazo[4,5-c]pyridin-2-yl)sulfanyl]-N-(3-methoxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-fluoro-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(3-hydroxy-4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-(4-methylphenyl)acetamide;2-[(5-chloro-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]-N-[4-methyl-3-(trifluoromethoxy)phenyl]acetamide;N-(3-fluoro-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide;N-(3-hydroxy-4-methylphenyl)-2-[(5-methyl-3H-pyrrolo[2,3-c]pyridin-2-yl)sulfanyl]acetamide is sourced from PubChem (CID 159098747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).