N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine

C70H61Cl2F7N22O — CID 159573827

About N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine

N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine (PubChem CID 159573827) has the molecular formula C70H61Cl2F7N22O and a molecular weight of 1430.30 g/mol. Its IUPAC name is N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine.

Molecular Properties

• Compound Name: N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine
• PubChem CID: 159573827
• Molecular Formula: C70H61Cl2F7N22O
• Molecular Weight: 1430.30 g/mol
• Exact Mass: 1428.47
• IUPAC Name: N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine
• SMILES: CC(C)(O)c1cc(Nc2[nH]nc3ncc(F)cc23)nc(C2CCCCC2)n1.Cc1cc(Nc2[nH]nc3ncc(F)cc23)nc(-c2ccccc2Cl)c1C.Cc1cc(Nc2[nH]nc3ncc(F)cc23)nc(C2CC2)n1.Fc1cnc2n[nH]c(Nc3cc(C(F)(F)F)cc(-c4ccccc4Cl)n3)c2c1
• InChI: InChI=1S/C19H15ClFN5.C19H23FN6O.C18H10ClF4N5.C14H13FN6/c1-10-7-16(23-17(11(10)2)13-5-3-4-6-15(13)20)24-19-14-8-12(21)9-22-18(14)25-26-19;1-19(2,27)14-9-15(23-16(22-14)11-6-4-3-5-7-11)24-18-13-8-12(20)10-21-17(13)25-26-18;19-13-4-2-1-3-11(13)14-5-9(18(21,22)23)6-15(25-14)26-17-12-7-10(20)8-24-16(12)27-28-17;1-7-4-11(18-12(17-7)8-2-3-8)19-14-10-5-9(15)6-16-13(10)20-21-14/h3-9H,1-2H3,(H2,22,23,24,25,26);8-11,27H,3-7H2,1-2H3,(H2,21,22,23,24,25,26);1-8H,(H2,24,25,26,27,28);4-6,8H,2-3H2,1H3,(H2,16,17,18,19,20,21)
• InChIKey: MIDOOUCFDLMYRD-UHFFFAOYSA-N
• XLogP: 17.47
• TPSA: 311.97 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 19
• Rotatable Bonds: 13
• Heavy Atoms: 102
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1430.30
LogP ≤ 5	17.47
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	19

Frequently Asked Questions

What is the IUPAC name of N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine?

The IUPAC name of N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine (CID 159573827) is N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine.

What is the SMILES notation for N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine?

The canonical SMILES for N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine is CC(C)(O)c1cc(Nc2[nH]nc3ncc(F)cc23)nc(C2CCCCC2)n1.Cc1cc(Nc2[nH]nc3ncc(F)cc23)nc(-c2ccccc2Cl)c1C.Cc1cc(Nc2[nH]nc3ncc(F)cc23)nc(C2CC2)n1.Fc1cnc2n[nH]c(Nc3cc(C(F)(F)F)cc(-c4ccccc4Cl)n3)c2c1.

What is the InChIKey of N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine?

The InChIKey is MIDOOUCFDLMYRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15ClFN5.C19H23FN6O.C18H10ClF4N5.C14H13FN6/c1-10-7-16(23-17(11(10)2)13-5-3-4-6-15(13)20)24-19-14-8-12(21)9-22-18(14)25-26-19;1-19(2,27)14-9-15(23-16(22-14)11-6-4-3-5-7-11)24-18-13-8-12(20)10-21-17(13)25-26-18;19-13-4-2-1-3-11(13)14-5-9(18(21,22)23)6-15(25-14)26-17-12-7-10(20)8-24-16(12)27-28-17;1-7-4-11(18-12(17-7)8-2-3-8)19-14-10-5-9(15)6-16-13(10)20-21-14/h3-9H,1-2H3,(H2,22,23,24,25,26);8-11,27H,3-7H2,1-2H3,(H2,21,22,23,24,25,26);1-8H,(H2,24,25,26,27,28);4-6,8H,2-3H2,1H3,(H2,16,17,18,19,20,21).

What are the key properties of N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine?

N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine has a molecular weight of 1430.30 g/mol, XLogP of 17.47, 13 rotatable bonds, 9 hydrogen bond donors, and 19 hydrogen bond acceptors.

Where does this data come from?

All data for N-[6-(2-chlorophenyl)-4,5-dimethyl-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;N-[6-(2-chlorophenyl)-4-(trifluoromethyl)-2-pyridinyl]-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine;2-[2-cyclohexyl-6-[(5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-yl)amino]pyrimidin-4-yl]propan-2-ol;N-(2-cyclopropyl-6-methylpyrimidin-4-yl)-5-fluoro-2H-pyrazolo[3,4-b]pyridin-3-amine is sourced from PubChem (CID 159573827), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).