2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine

C158H186F4N48O6 — CID 163800632

IUPAC2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine
SMILESCCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2cccnc2C(C)C)CC1.CCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2cccnc2C2CC2)CC1.CCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2nccnc2C)CC1.CCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2nccnc2CC)CC1.CCNc1cc2c(cn1)c(-c1cnn(C)c1)nn2C1CCC(Oc2cccnc2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1cnn(C)c1)nn2C1CCC(Oc2cccnc2F)CC1
InChIInChI=1S/C29H34N8O.C29H36N8O.C27H33N9O.C26H31N9O.C24H26F3N7O.C23H26FN7O/c1-4-31-26-14-24-23(16-33-26)27(20-15-34-36(17-20)29(2,3)18-30)35-37(24)21-9-11-22(12-10-21)38-25-6-5-13-32-28(25)19-7-8-19;1-6-31-26-14-24-23(16-33-26)28(20-15-34-36(17-20)29(4,5)18-30)35-37(24)21-9-11-22(12-10-21)38-25-8-7-13-32-27(25)19(2)3;1-5-22-26(31-12-11-30-22)37-20-9-7-19(8-10-20)36-23-13-24(29-6-2)32-15-21(23)25(34-36)18-14-33-35(16-18)27(3,4)17-28;1-5-28-23-12-22-21(14-31-23)24(18-13-32-34(15-18)26(3,4)16-27)33-35(22)19-6-8-20(9-7-19)36-25-17(2)29-10-11-30-25;1-3-28-21-11-19-18(13-30-21)22(15-12-31-33(2)14-15)32-34(19)16-6-8-17(9-7-16)35-20-5-4-10-29-23(20)24(25,26)27;1-3-25-21-11-19-18(13-27-21)22(15-12-28-30(2)14-15)29-31(19)16-6-8-17(9-7-16)32-20-5-4-10-26-23(20)24/h5-6,13-17,19,21-22H,4,7-12H2,1-3H3,(H,31,33);7-8,13-17,19,21-22H,6,9-12H2,1-5H3,(H,31,33);11-16,19-20H,5-10H2,1-4H3,(H,29,32);10-15,19-20H,5-9H2,1-4H3,(H,28,31);4-5,10-14,16-17H,3,6-9H2,1-2H3,(H,28,30);4-5,10-14,16-17H,3,6-9H2,1-2H3,(H,25,27)
InChIKeyNEQFNGUAELXXMC-UHFFFAOYSA-N
MW2929.55 g/mol
LogP31.03
Rot. Bonds43

About 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine

2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine (PubChem CID 163800632) has the molecular formula C158H186F4N48O6 and a molecular weight of 2929.55 g/mol. Its IUPAC name is 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine.

Molecular Properties

Compound Name2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine
PubChem CID163800632
Molecular FormulaC158H186F4N48O6
Molecular Weight2929.55 g/mol
Exact Mass2927.57
IUPAC Name2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine
SMILESCCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2cccnc2C(C)C)CC1.CCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2cccnc2C2CC2)CC1.CCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2nccnc2C)CC1.CCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2nccnc2CC)CC1.CCNc1cc2c(cn1)c(-c1cnn(C)c1)nn2C1CCC(Oc2cccnc2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1cnn(C)c1)nn2C1CCC(Oc2cccnc2F)CC1
InChIInChI=1S/C29H34N8O.C29H36N8O.C27H33N9O.C26H31N9O.C24H26F3N7O.C23H26FN7O/c1-4-31-26-14-24-23(16-33-26)27(20-15-34-36(17-20)29(2,3)18-30)35-37(24)21-9-11-22(12-10-21)38-25-6-5-13-32-28(25)19-7-8-19;1-6-31-26-14-24-23(16-33-26)28(20-15-34-36(17-20)29(4,5)18-30)35-37(24)21-9-11-22(12-10-21)38-25-8-7-13-32-27(25)19(2)3;1-5-22-26(31-12-11-30-22)37-20-9-7-19(8-10-20)36-23-13-24(29-6-2)32-15-21(23)25(34-36)18-14-33-35(16-18)27(3,4)17-28;1-5-28-23-12-22-21(14-31-23)24(18-13-32-34(15-18)26(3,4)16-27)33-35(22)19-6-8-20(9-7-19)36-25-17(2)29-10-11-30-25;1-3-28-21-11-19-18(13-30-21)22(15-12-31-33(2)14-15)32-34(19)16-6-8-17(9-7-16)35-20-5-4-10-29-23(20)24(25,26)27;1-3-25-21-11-19-18(13-27-21)22(15-12-28-30(2)14-15)29-31(19)16-6-8-17(9-7-16)32-20-5-4-10-26-23(20)24/h5-6,13-17,19,21-22H,4,7-12H2,1-3H3,(H,31,33);7-8,13-17,19,21-22H,6,9-12H2,1-5H3,(H,31,33);11-16,19-20H,5-10H2,1-4H3,(H,29,32);10-15,19-20H,5-9H2,1-4H3,(H,28,31);4-5,10-14,16-17H,3,6-9H2,1-2H3,(H,28,30);4-5,10-14,16-17H,3,6-9H2,1-2H3,(H,25,27)
InChIKeyNEQFNGUAELXXMC-UHFFFAOYSA-N
XLogP31.03
TPSA617.02 Ų
H-Bond Donors6
H-Bond Acceptors54
Rotatable Bonds43
Heavy Atoms216
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5002929.55
LogP ≤ 531.03
H-Bond Donors ≤ 56
H-Bond Acceptors ≤ 1054

Computed Properties (RDKit)

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

Analyze 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine with MolForge

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Frequently Asked Questions

What is the IUPAC name of 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine?
The IUPAC name of 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine (CID 163800632) is 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine.
What is the SMILES notation for 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine?
The canonical SMILES for 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine is CCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2cccnc2C(C)C)CC1.CCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2cccnc2C2CC2)CC1.CCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2nccnc2C)CC1.CCNc1cc2c(cn1)c(-c1cnn(C(C)(C)C#N)c1)nn2C1CCC(Oc2nccnc2CC)CC1.CCNc1cc2c(cn1)c(-c1cnn(C)c1)nn2C1CCC(Oc2cccnc2C(F)(F)F)CC1.CCNc1cc2c(cn1)c(-c1cnn(C)c1)nn2C1CCC(Oc2cccnc2F)CC1.
What is the InChIKey of 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine?
The InChIKey is NEQFNGUAELXXMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H34N8O.C29H36N8O.C27H33N9O.C26H31N9O.C24H26F3N7O.C23H26FN7O/c1-4-31-26-14-24-23(16-33-26)27(20-15-34-36(17-20)29(2,3)18-30)35-37(24)21-9-11-22(12-10-21)38-25-6-5-13-32-28(25)19-7-8-19;1-6-31-26-14-24-23(16-33-26)28(20-15-34-36(17-20)29(4,5)18-30)35-37(24)21-9-11-22(12-10-21)38-25-8-7-13-32-27(25)19(2)3;1-5-22-26(31-12-11-30-22)37-20-9-7-19(8-10-20)36-23-13-24(29-6-2)32-15-21(23)25(34-36)18-14-33-35(16-18)27(3,4)17-28;1-5-28-23-12-22-21(14-31-23)24(18-13-32-34(15-18)26(3,4)16-27)33-35(22)19-6-8-20(9-7-19)36-25-17(2)29-10-11-30-25;1-3-28-21-11-19-18(13-30-21)22(15-12-31-33(2)14-15)32-34(19)16-6-8-17(9-7-16)35-20-5-4-10-29-23(20)24(25,26)27;1-3-25-21-11-19-18(13-27-21)22(15-12-28-30(2)14-15)29-31(19)16-6-8-17(9-7-16)32-20-5-4-10-26-23(20)24/h5-6,13-17,19,21-22H,4,7-12H2,1-3H3,(H,31,33);7-8,13-17,19,21-22H,6,9-12H2,1-5H3,(H,31,33);11-16,19-20H,5-10H2,1-4H3,(H,29,32);10-15,19-20H,5-9H2,1-4H3,(H,28,31);4-5,10-14,16-17H,3,6-9H2,1-2H3,(H,28,30);4-5,10-14,16-17H,3,6-9H2,1-2H3,(H,25,27).
What are the key properties of 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine?
2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine has a molecular weight of 2929.55 g/mol, XLogP of 31.03, 43 rotatable bonds, 6 hydrogen bond donors, and 54 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-[1-[4-[(2-cyclopropyl-3-pyridinyl)oxy]cyclohexyl]-6-(ethylamino)pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-ethylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-(3-methylpyrazin-2-yl)oxycyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;2-[4-[6-(ethylamino)-1-[4-[(2-propan-2-yl-3-pyridinyl)oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-3-yl]pyrazol-1-yl]-2-methylpropanenitrile;N-ethyl-1-[4-[(2-fluoro-3-pyridinyl)oxy]cyclohexyl]-3-(1-methylpyrazol-4-yl)pyrazolo[4,3-c]pyridin-6-amine;N-ethyl-3-(1-methylpyrazol-4-yl)-1-[4-[[2-(trifluoromethyl)-3-pyridinyl]oxy]cyclohexyl]pyrazolo[4,3-c]pyridin-6-amine is sourced from PubChem (CID 163800632), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).