potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide

C81H87BCl2IKN21O10- — CID 157451905

About potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide

potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide (PubChem CID 157451905) has the molecular formula C81H87BCl2IKN21O10- and a molecular weight of 1762.44 g/mol. Its IUPAC name is potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide.

Molecular Properties

• Compound Name: potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide
• PubChem CID: 157451905
• Molecular Formula: C81H87BCl2IKN21O10-
• Molecular Weight: 1762.44 g/mol
• Exact Mass: 1760.51
• IUPAC Name: potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide
• SMILES: CC(C)(C)[O-].CC1(C)OB(c2ccc3cc(C#N)cnn23)OC1(C)C.COC(=O)c1cnc(Cl)cc1N[C@H]1CCC[C@@H](O)C1.N#Cc1ccc(N)nc1.N#Cc1ccc(NC(=O)c2cnc(-c3ccc4cc(C#N)cnn34)cc2N[C@H]2CCC[C@@H](O)C2)nc1.N#Cc1ccc(NC(=O)c2cnc(Cl)cc2N[C@H]2CCC[C@@H](O)C2)nc1.[I-].[K+]
• InChI: InChI=1S/C26H22N8O2.C18H18ClN5O2.C14H16BN3O2.C13H17ClN2O3.C6H5N3.C4H9O.HI.K/c27-11-16-4-7-25(30-13-16)33-26(36)21-15-29-23(10-22(21)32-18-2-1-3-20(35)9-18)24-6-5-19-8-17(12-28)14-31-34(19)24;19-16-7-15(23-12-2-1-3-13(25)6-12)14(10-21-16)18(26)24-17-5-4-11(8-20)9-22-17;1-13(2)14(3,4)20-15(19-13)12-6-5-11-7-10(8-16)9-17-18(11)12;1-19-13(18)10-7-15-12(14)6-11(10)16-8-3-2-4-9(17)5-8;7-3-5-1-2-6(8)9-4-5;1-4(2,3)5;;/h4-8,10,13-15,18,20,35H,1-3,9H2,(H,29,32)(H,30,33,36);4-5,7,9-10,12-13,25H,1-3,6H2,(H,21,23)(H,22,24,26);5-7,9H,1-4H3;6-9,17H,2-5H2,1H3,(H,15,16);1-2,4H,(H2,8,9);1-3H3;1H;/q;;;;;-1;;+1/p-1/t18-,20+;12-,13+;;8-,9+;;;;/m00.0..../s1
• InChIKey: HNVNLLYCMFGAOE-GRQGELOASA-M
• XLogP: 4.90
• TPSA: 479.71 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 29
• Rotatable Bonds: 13
• Heavy Atoms: 117
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1762.44
LogP ≤ 5	4.90
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	29

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide?

The IUPAC name of potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide (CID 157451905) is potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide.

What is the SMILES notation for potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide?

The canonical SMILES for potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide is CC(C)(C)[O-].CC1(C)OB(c2ccc3cc(C#N)cnn23)OC1(C)C.COC(=O)c1cnc(Cl)cc1N[C@H]1CCC[C@@H](O)C1.N#Cc1ccc(N)nc1.N#Cc1ccc(NC(=O)c2cnc(-c3ccc4cc(C#N)cnn34)cc2N[C@H]2CCC[C@@H](O)C2)nc1.N#Cc1ccc(NC(=O)c2cnc(Cl)cc2N[C@H]2CCC[C@@H](O)C2)nc1.[I-].[K+].

What is the InChIKey of potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide?

The InChIKey is HNVNLLYCMFGAOE-GRQGELOASA-M. The full InChI is InChI=1S/C26H22N8O2.C18H18ClN5O2.C14H16BN3O2.C13H17ClN2O3.C6H5N3.C4H9O.HI.K/c27-11-16-4-7-25(30-13-16)33-26(36)21-15-29-23(10-22(21)32-18-2-1-3-20(35)9-18)24-6-5-19-8-17(12-28)14-31-34(19)24;19-16-7-15(23-12-2-1-3-13(25)6-12)14(10-21-16)18(26)24-17-5-4-11(8-20)9-22-17;1-13(2)14(3,4)20-15(19-13)12-6-5-11-7-10(8-16)9-17-18(11)12;1-19-13(18)10-7-15-12(14)6-11(10)16-8-3-2-4-9(17)5-8;7-3-5-1-2-6(8)9-4-5;1-4(2,3)5;;/h4-8,10,13-15,18,20,35H,1-3,9H2,(H,29,32)(H,30,33,36);4-5,7,9-10,12-13,25H,1-3,6H2,(H,21,23)(H,22,24,26);5-7,9H,1-4H3;6-9,17H,2-5H2,1H3,(H,15,16);1-2,4H,(H2,8,9);1-3H3;1H;/q;;;;;-1;;+1/p-1/t18-,20+;12-,13+;;8-,9+;;;;/m00.0..../s1.

What are the key properties of potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide?

potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide has a molecular weight of 1762.44 g/mol, XLogP of 4.90, 13 rotatable bonds, 9 hydrogen bond donors, and 29 hydrogen bond acceptors.

Where does this data come from?

All data for potassium;6-aminopyridine-3-carbonitrile;6-chloro-N-(5-cyano-2-pyridinyl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;N-(5-cyano-2-pyridinyl)-6-(3-cyanopyrrolo[1,2-b]pyridazin-7-yl)-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxamide;methyl 6-chloro-4-[[(1S,3R)-3-hydroxycyclohexyl]amino]pyridine-3-carboxylate;2-methylpropan-2-olate;7-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)pyrrolo[1,2-b]pyridazine-3-carbonitrile;iodide is sourced from PubChem (CID 157451905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).