N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide

C115H70Br2Cl5F10N15O19 — CID 157495040

About N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide

N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide (PubChem CID 157495040) has the molecular formula C115H70Br2Cl5F10N15O19 and a molecular weight of 2492.96 g/mol. Its IUPAC name is N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide.

Molecular Properties

• Compound Name: N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide
• PubChem CID: 157495040
• Molecular Formula: C115H70Br2Cl5F10N15O19
• Molecular Weight: 2492.96 g/mol
• Exact Mass: 2487.16
• IUPAC Name: N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide
• SMILES: Cc1cccc(C(=O)Nc2ccc(-c3cc4c(cc3Br)OCO4)cn2)c1C.Cc1nc(NC(=O)c2ccccc2Cl)ccc1-c1cc2c(cc1C=O)OCO2.O=C(Nc1ccc(-c2cc3c(cc2Br)OCO3)cn1)c1ccccc1F.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1c(F)cccc1F.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1ccccc1Cl.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1ccccc1F
• InChI: InChI=1S/C21H17BrN2O3.C21H15ClN2O4.C19H12BrFN2O3.C18H9Cl2F2N3O3.C18H8ClF4N3O3.C18H9ClF3N3O3/c1-12-4-3-5-15(13(12)2)21(25)24-20-7-6-14(10-23-20)16-8-18-19(9-17(16)22)27-11-26-18;1-12-14(16-9-19-18(27-11-28-19)8-13(16)10-25)6-7-20(23-12)24-21(26)15-4-2-3-5-17(15)22;20-14-8-17-16(25-10-26-17)7-13(14)11-5-6-18(22-9-11)23-19(24)12-3-1-2-4-15(12)21;19-11-4-2-1-3-9(11)17(26)25-16-8-23-13(7-24-16)10-5-14-15(6-12(10)20)28-18(21,22)27-14;19-9-5-14-13(28-18(22,23)29-14)4-8(9)12-6-25-15(7-24-12)26-17(27)16-10(20)2-1-3-11(16)21;19-11-6-15-14(27-18(21,22)28-15)5-10(11)13-7-24-16(8-23-13)25-17(26)9-3-1-2-4-12(9)20/h3-10H,11H2,1-2H3,(H,23,24,25);2-10H,11H2,1H3,(H,23,24,26);1-9H,10H2,(H,22,23,24);1-8H,(H,24,25,26);1-7H,(H,25,26,27);1-8H,(H,24,25,26)
• InChIKey: BXSNLVXQOKZNGF-UHFFFAOYSA-N
• XLogP: 28.43
• TPSA: 418.44 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 28
• Rotatable Bonds: 19
• Heavy Atoms: 166
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2492.96
LogP ≤ 5	28.43
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide?

The IUPAC name of N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide (CID 157495040) is N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide.

What is the SMILES notation for N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide?

The canonical SMILES for N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide is Cc1cccc(C(=O)Nc2ccc(-c3cc4c(cc3Br)OCO4)cn2)c1C.Cc1nc(NC(=O)c2ccccc2Cl)ccc1-c1cc2c(cc1C=O)OCO2.O=C(Nc1ccc(-c2cc3c(cc2Br)OCO3)cn1)c1ccccc1F.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1c(F)cccc1F.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1ccccc1Cl.O=C(Nc1cnc(-c2cc3c(cc2Cl)OC(F)(F)O3)cn1)c1ccccc1F.

What is the InChIKey of N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide?

The InChIKey is BXSNLVXQOKZNGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17BrN2O3.C21H15ClN2O4.C19H12BrFN2O3.C18H9Cl2F2N3O3.C18H8ClF4N3O3.C18H9ClF3N3O3/c1-12-4-3-5-15(13(12)2)21(25)24-20-7-6-14(10-23-20)16-8-18-19(9-17(16)22)27-11-26-18;1-12-14(16-9-19-18(27-11-28-19)8-13(16)10-25)6-7-20(23-12)24-21(26)15-4-2-3-5-17(15)22;20-14-8-17-16(25-10-26-17)7-13(14)11-5-6-18(22-9-11)23-19(24)12-3-1-2-4-15(12)21;19-11-4-2-1-3-9(11)17(26)25-16-8-23-13(7-24-16)10-5-14-15(6-12(10)20)28-18(21,22)27-14;19-9-5-14-13(28-18(22,23)29-14)4-8(9)12-6-25-15(7-24-12)26-17(27)16-10(20)2-1-3-11(16)21;19-11-6-15-14(27-18(21,22)28-15)5-10(11)13-7-24-16(8-23-13)25-17(26)9-3-1-2-4-12(9)20/h3-10H,11H2,1-2H3,(H,23,24,25);2-10H,11H2,1H3,(H,23,24,26);1-9H,10H2,(H,22,23,24);1-8H,(H,24,25,26);1-7H,(H,25,26,27);1-8H,(H,24,25,26).

What are the key properties of N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide?

N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide has a molecular weight of 2492.96 g/mol, XLogP of 28.43, 19 rotatable bonds, 6 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2,3-dimethylbenzamide;N-[5-(6-bromo-1,3-benzodioxol-5-yl)-2-pyridinyl]-2-fluorobenzamide;2-chloro-N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]benzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2,6-difluorobenzamide;N-[5-(6-chloro-2,2-difluoro-1,3-benzodioxol-5-yl)pyrazin-2-yl]-2-fluorobenzamide;2-chloro-N-[5-(6-formyl-1,3-benzodioxol-5-yl)-6-methyl-2-pyridinyl]benzamide is sourced from PubChem (CID 157495040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).