4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine

C138H155F13N34O9S2 — CID 163830515

About 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine

4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine (PubChem CID 163830515) has the molecular formula C138H155F13N34O9S2 and a molecular weight of 2745.09 g/mol. Its IUPAC name is 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine.

Molecular Properties

• Compound Name: 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine
• PubChem CID: 163830515
• Molecular Formula: C138H155F13N34O9S2
• Molecular Weight: 2745.09 g/mol
• Exact Mass: 2743.20
• IUPAC Name: 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine
• SMILES: CCNc1cc2c(cn1)c(-c1ccc(CN3CCN(C)CC3)cc1)nn2C1CCC(Oc2cnn(C)c2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1ccc(S(C)(=O)=O)cc1)nn2C1CCC(Oc2cnn(C)c2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1ccc3c(c1)CN(C)C3=O)nn2C1CCC(Oc2cnn(C)c2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1ccc3c(c1)CNC3=S)nn2C1CCC(Oc2cnn(C)c2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1ccn(C)c(=O)c1)nn2C1CCC(Oc2nccc(C)c2F)CC1
• InChI: InChI=1S/C31H39F3N8O.C28H30F3N7O2.C27H28F3N7OS.C26H29F3N6O3S.C26H29FN6O2/c1-4-35-28-17-26-25(18-36-28)29(22-7-5-21(6-8-22)20-41-15-13-39(2)14-16-41)38-42(26)23-9-11-24(12-10-23)43-27-19-37-40(3)30(27)31(32,33)34;1-4-32-24-12-22-21(13-33-24)25(16-5-10-20-17(11-16)15-36(2)27(20)39)35-38(22)18-6-8-19(9-7-18)40-23-14-34-37(3)26(23)28(29,30)31;1-3-31-23-11-21-20(13-32-23)24(15-4-9-19-16(10-15)12-33-26(19)39)35-37(21)17-5-7-18(8-6-17)38-22-14-34-36(2)25(22)27(28,29)30;1-4-30-23-13-21-20(14-31-23)24(16-5-11-19(12-6-16)39(3,36)37)33-35(21)17-7-9-18(10-8-17)38-22-15-32-34(2)25(22)26(27,28)29;1-4-28-22-14-21-20(15-30-22)25(17-10-12-32(3)23(34)13-17)31-33(21)18-5-7-19(8-6-18)35-26-24(27)16(2)9-11-29-26/h5-8,17-19,23-24H,4,9-16,20H2,1-3H3,(H,35,36);5,10-14,18-19H,4,6-9,15H2,1-3H3,(H,32,33);4,9-11,13-14,17-18H,3,5-8,12H2,1-2H3,(H,31,32)(H,33,39);5-6,11-15,17-18H,4,7-10H2,1-3H3,(H,30,31);9-15,18-19H,4-8H2,1-3H3,(H,28,30)
• InChIKey: ODGNASRMQBGXOI-UHFFFAOYSA-N
• XLogP: 26.53
• TPSA: 438.98 Ų
• H-Bond Donors: 6
• H-Bond Acceptors: 42
• Rotatable Bonds: 33
• Heavy Atoms: 196
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2745.09
LogP ≤ 5	26.53
H-Bond Donors ≤ 5	6
H-Bond Acceptors ≤ 10	42

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine?

The IUPAC name of 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine (CID 163830515) is 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine.

What is the SMILES notation for 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine?

The canonical SMILES for 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine is CCNc1cc2c(cn1)c(-c1ccc(CN3CCN(C)CC3)cc1)nn2C1CCC(Oc2cnn(C)c2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1ccc(S(C)(=O)=O)cc1)nn2C1CCC(Oc2cnn(C)c2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1ccc3c(c1)CN(C)C3=O)nn2C1CCC(Oc2cnn(C)c2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1ccc3c(c1)CNC3=S)nn2C1CCC(Oc2cnn(C)c2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1ccn(C)c(=O)c1)nn2C1CCC(Oc2nccc(C)c2F)CC1.

What is the InChIKey of 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine?

The InChIKey is ODGNASRMQBGXOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C31H39F3N8O.C28H30F3N7O2.C27H28F3N7OS.C26H29F3N6O3S.C26H29FN6O2/c1-4-35-28-17-26-25(18-36-28)29(22-7-5-21(6-8-22)20-41-15-13-39(2)14-16-41)38-42(26)23-9-11-24(12-10-23)43-27-19-37-40(3)30(27)31(32,33)34;1-4-32-24-12-22-21(13-33-24)25(16-5-10-20-17(11-16)15-36(2)27(20)39)35-38(22)18-6-8-19(9-7-18)40-23-14-34-37(3)26(23)28(29,30)31;1-3-31-23-11-21-20(13-32-23)24(15-4-9-19-16(10-15)12-33-26(19)39)35-37(21)17-5-7-18(8-6-17)38-22-14-34-36(2)25(22)27(28,29)30;1-4-30-23-13-21-20(14-31-23)24(16-5-11-19(12-6-16)39(3,36)37)33-35(21)17-7-9-18(10-8-17)38-22-15-32-34(2)25(22)26(27,28)29;1-4-28-22-14-21-20(15-30-22)25(17-10-12-32(3)23(34)13-17)31-33(21)18-5-7-19(8-6-18)35-26-24(27)16(2)9-11-29-26/h5-8,17-19,23-24H,4,9-16,20H2,1-3H3,(H,35,36);5,10-14,18-19H,4,6-9,15H2,1-3H3,(H,32,33);4,9-11,13-14,17-18H,3,5-8,12H2,1-2H3,(H,31,32)(H,33,39);5-6,11-15,17-18H,4,7-10H2,1-3H3,(H,30,31);9-15,18-19H,4-8H2,1-3H3,(H,28,30).

What are the key properties of 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine?

4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine has a molecular weight of 2745.09 g/mol, XLogP of 26.53, 33 rotatable bonds, 6 hydrogen bond donors, and 42 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[6-(ethylamino)-1-[4-[(3-fluoro-4-methyl-2-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-1-methylpyridin-2-one;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2,3-dihydroisoindole-1-thione;5-[6-(ethylamino)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]-2-methyl-3H-isoindol-1-one;N-ethyl-3-[4-[(4-methylpiperazin-1-yl)methyl]phenyl]-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(4-methylsulfonylphenyl)-1-[4-[1-methyl-5-(trifluoromethyl)pyrazol-4-yl]oxycyclohexyl]pyrazolo[4,3-c]pyridin-6-amine is sourced from PubChem (CID 163830515), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).