2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide

C75H79Cl3N32O8 — CID 160684816

About 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide

2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide (PubChem CID 160684816) has the molecular formula C75H79Cl3N32O8 and a molecular weight of 1669.07 g/mol. Its IUPAC name is 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide.

Molecular Properties

• Compound Name: 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide
• PubChem CID: 160684816
• Molecular Formula: C75H79Cl3N32O8
• Molecular Weight: 1669.07 g/mol
• Exact Mass: 1666.62
• IUPAC Name: 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide
• SMILES: COc1c(-c2ncn(C)n2)ccnc1Cl.COc1c(-c2ncn(C)n2)ccnc1N.COc1c(-c2ncn[nH]2)ccnc1Cl.[2H]C([2H])([2H])n1cnc(-c2ccnc(Nc3cc(Cl)nnc3C(=O)NC)c2OC)n1.[2H]C([2H])([2H])n1cnc(-c2ccnc(Nc3cc(N4CCN(C(C)C)C4=O)nnc3C(=O)NC)c2OC)n1.[H]N=C(c1ccccc1)c1ccccc1
• InChI: InChI=1S/C21H26N10O3.C15H15ClN8O2.C13H11N.C9H9ClN4O.C9H11N5O.C8H7ClN4O/c1-12(2)30-8-9-31(21(30)33)15-10-14(16(27-26-15)20(32)22-3)25-19-17(34-5)13(6-7-23-19)18-24-11-29(4)28-18;1-17-15(25)11-9(6-10(16)21-22-11)20-14-12(26-3)8(4-5-18-14)13-19-7-24(2)23-13;14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;2*1-14-5-12-9(13-14)6-3-4-11-8(10)7(6)15-2;1-14-6-5(2-3-10-7(6)9)8-11-4-12-13-8/h6-7,10-12H,8-9H2,1-5H3,(H,22,32)(H,23,25,26);4-7H,1-3H3,(H,17,25)(H,18,20,21);1-10,14H;3-5H,1-2H3;3-5H,1-2H3,(H2,10,11);2-4H,1H3,(H,11,12,13)/i4D3;2D3
• InChIKey: ROPSYVVFZBHUJW-QVJFLREFSA-N
• XLogP: 9.50
• TPSA: 482.25 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 35
• Rotatable Bonds: 22
• Heavy Atoms: 118
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1669.07
LogP ≤ 5	9.50
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	35

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide?

The IUPAC name of 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide (CID 160684816) is 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide.

What is the SMILES notation for 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide?

The canonical SMILES for 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide is COc1c(-c2ncn(C)n2)ccnc1Cl.COc1c(-c2ncn(C)n2)ccnc1N.COc1c(-c2ncn[nH]2)ccnc1Cl.[2H]C([2H])([2H])n1cnc(-c2ccnc(Nc3cc(Cl)nnc3C(=O)NC)c2OC)n1.[2H]C([2H])([2H])n1cnc(-c2ccnc(Nc3cc(N4CCN(C(C)C)C4=O)nnc3C(=O)NC)c2OC)n1.[H]N=C(c1ccccc1)c1ccccc1.

What is the InChIKey of 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide?

The InChIKey is ROPSYVVFZBHUJW-QVJFLREFSA-N. The full InChI is InChI=1S/C21H26N10O3.C15H15ClN8O2.C13H11N.C9H9ClN4O.C9H11N5O.C8H7ClN4O/c1-12(2)30-8-9-31(21(30)33)15-10-14(16(27-26-15)20(32)22-3)25-19-17(34-5)13(6-7-23-19)18-24-11-29(4)28-18;1-17-15(25)11-9(6-10(16)21-22-11)20-14-12(26-3)8(4-5-18-14)13-19-7-24(2)23-13;14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;2*1-14-5-12-9(13-14)6-3-4-11-8(10)7(6)15-2;1-14-6-5(2-3-10-7(6)9)8-11-4-12-13-8/h6-7,10-12H,8-9H2,1-5H3,(H,22,32)(H,23,25,26);4-7H,1-3H3,(H,17,25)(H,18,20,21);1-10,14H;3-5H,1-2H3;3-5H,1-2H3,(H2,10,11);2-4H,1H3,(H,11,12,13)/i4D3;2D3;;;;.

What are the key properties of 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide?

2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide has a molecular weight of 1669.07 g/mol, XLogP of 9.50, 22 rotatable bonds, 7 hydrogen bond donors, and 35 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridine;2-chloro-3-methoxy-4-(1H-1,2,4-triazol-5-yl)pyridine;6-chloro-4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methylpyridazine-3-carboxamide;diphenylmethanimine;3-methoxy-4-(1-methyl-1,2,4-triazol-3-yl)pyridin-2-amine;4-[[3-methoxy-4-[1-(trideuteriomethyl)-1,2,4-triazol-3-yl]-2-pyridinyl]amino]-N-methyl-6-(2-oxo-3-propan-2-ylimidazolidin-1-yl)pyridazine-3-carboxamide is sourced from PubChem (CID 160684816), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).