5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide

C135H120BrF15N24O24 — CID 165090672

About 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide

5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide (PubChem CID 165090672) has the molecular formula C135H120BrF15N24O24 and a molecular weight of 2827.46 g/mol. Its IUPAC name is 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide.

Molecular Properties

• Compound Name: 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide
• PubChem CID: 165090672
• Molecular Formula: C135H120BrF15N24O24
• Molecular Weight: 2827.46 g/mol
• Exact Mass: 2824.79
• IUPAC Name: 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide
• SMILES: CCCOc1cc(-c2cc(NC(=O)c3ccc4c(c3)OC(F)(F)O4)cnc2C)cc(N2CCOCC2)n1.Cc1ncc(N)cc1-c1cc(F)nc(F)c1.Cc1ncc(N)cc1Br.Cc1ncc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cc1-c1cc(F)nc(F)c1.Cc1ncc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cc1-c1cc(F)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cc1-c1cc(OCCO)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cc1-c1cc(OCCO)nc(N2CCOCC2)c1
• InChI: InChI=1S/C26H26F2N4O5.2C25H24F2N4O6.C23H19F3N4O4.C19H11F4N3O3.C11H9F2N3.C6H7BrN2/c1-3-8-35-24-13-18(12-23(31-24)32-6-9-34-10-7-32)20-14-19(15-29-16(20)2)30-25(33)17-4-5-21-22(11-17)37-26(27,28)36-21;2*1-15-19(17-11-22(31-4-7-34-8-5-31)30-23(12-17)35-9-6-32)13-18(14-28-15)29-24(33)16-2-3-20-21(10-16)37-25(26,27)36-20;1-13-17(15-9-20(24)29-21(10-15)30-4-6-32-7-5-30)11-16(12-27-13)28-22(31)14-2-3-18-19(8-14)34-23(25,26)33-18;1-9-13(11-5-16(20)26-17(21)6-11)7-12(8-24-9)25-18(27)10-2-3-14-15(4-10)29-19(22,23)28-14;1-6-9(4-8(14)5-15-6)7-2-10(12)16-11(13)3-7;1-4-6(7)2-5(8)3-9-4/h4-5,11-15H,3,6-10H2,1-2H3,(H,30,33);2*2-3,10-14,32H,4-9H2,1H3,(H,29,33);2-3,8-12H,4-7H2,1H3,(H,28,31);2-8H,1H3,(H,25,27);2-5H,14H2,1H3;2-3H,8H2,1H3
• InChIKey: WQKDXYIMOLZVSG-UHFFFAOYSA-N
• XLogP: 23.47
• TPSA: 575.44 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 43
• Rotatable Bonds: 29
• Heavy Atoms: 199
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2827.46
LogP ≤ 5	23.47
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	43

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide?

The IUPAC name of 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide (CID 165090672) is 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide.

What is the SMILES notation for 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide?

The canonical SMILES for 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide is CCCOc1cc(-c2cc(NC(=O)c3ccc4c(c3)OC(F)(F)O4)cnc2C)cc(N2CCOCC2)n1.Cc1ncc(N)cc1-c1cc(F)nc(F)c1.Cc1ncc(N)cc1Br.Cc1ncc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cc1-c1cc(F)nc(F)c1.Cc1ncc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cc1-c1cc(F)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cc1-c1cc(OCCO)nc(N2CCOCC2)c1.Cc1ncc(NC(=O)c2ccc3c(c2)OC(F)(F)O3)cc1-c1cc(OCCO)nc(N2CCOCC2)c1.

What is the InChIKey of 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide?

The InChIKey is WQKDXYIMOLZVSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H26F2N4O5.2C25H24F2N4O6.C23H19F3N4O4.C19H11F4N3O3.C11H9F2N3.C6H7BrN2/c1-3-8-35-24-13-18(12-23(31-24)32-6-9-34-10-7-32)20-14-19(15-29-16(20)2)30-25(33)17-4-5-21-22(11-17)37-26(27,28)36-21;2*1-15-19(17-11-22(31-4-7-34-8-5-31)30-23(12-17)35-9-6-32)13-18(14-28-15)29-24(33)16-2-3-20-21(10-16)37-25(26,27)36-20;1-13-17(15-9-20(24)29-21(10-15)30-4-6-32-7-5-30)11-16(12-27-13)28-22(31)14-2-3-18-19(8-14)34-23(25,26)33-18;1-9-13(11-5-16(20)26-17(21)6-11)7-12(8-24-9)25-18(27)10-2-3-14-15(4-10)29-19(22,23)28-14;1-6-9(4-8(14)5-15-6)7-2-10(12)16-11(13)3-7;1-4-6(7)2-5(8)3-9-4/h4-5,11-15H,3,6-10H2,1-2H3,(H,30,33);2*2-3,10-14,32H,4-9H2,1H3,(H,29,33);2-3,8-12H,4-7H2,1H3,(H,28,31);2-8H,1H3,(H,25,27);2-5H,14H2,1H3;2-3H,8H2,1H3.

What are the key properties of 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide?

5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide has a molecular weight of 2827.46 g/mol, XLogP of 23.47, 29 rotatable bonds, 9 hydrogen bond donors, and 43 hydrogen bond acceptors.

Where does this data come from?

All data for 5-bromo-6-methylpyridin-3-amine;2,2-difluoro-N-[5-(2-fluoro-6-morpholin-4-yl-4-pyridinyl)-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;bis(2,2-difluoro-N-[5-[2-(2-hydroxyethoxy)-6-morpholin-4-yl-4-pyridinyl]-6-methyl-3-pyridinyl]-1,3-benzodioxole-5-carboxamide);2,2-difluoro-N-[6-methyl-5-(2-morpholin-4-yl-6-propoxy-4-pyridinyl)-3-pyridinyl]-1,3-benzodioxole-5-carboxamide;5-(2,6-difluoro-4-pyridinyl)-6-methylpyridin-3-amine;N-[5-(2,6-difluoro-4-pyridinyl)-6-methyl-3-pyridinyl]-2,2-difluoro-1,3-benzodioxole-5-carboxamide is sourced from PubChem (CID 165090672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).