6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine

C79H77Cl13F5N17O10 — CID 158648988

About 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine

6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine (PubChem CID 158648988) has the molecular formula C79H77Cl13F5N17O10 and a molecular weight of 1980.47 g/mol. Its IUPAC name is 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine.

Molecular Properties

• Compound Name: 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine
• PubChem CID: 158648988
• Molecular Formula: C79H77Cl13F5N17O10
• Molecular Weight: 1980.47 g/mol
• Exact Mass: 1973.19
• IUPAC Name: 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine
• SMILES: C.CC(Oc1cc(C(=O)Cl)nnc1N(C)C)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(C(=O)O)nnc1N(C)C)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(Cl)nnc1N(C)C)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(Cl)nnc1N)c1c(Cl)ccc(F)c1Cl.CCOC(=O)c1cc(OC(C)c2c(Cl)ccc(F)c2Cl)c(N(C)C)nn1.Nc1ccncc1
• InChI: InChI=1S/C17H18Cl2FN3O3.C15H13Cl3FN3O2.C15H14Cl2FN3O3.C14H13Cl3FN3O.C12H9Cl3FN3O.C5H6N2.CH4/c1-5-25-17(24)12-8-13(16(22-21-12)23(3)4)26-9(2)14-10(18)6-7-11(20)15(14)19;1-7(12-8(16)4-5-9(19)13(12)17)24-11-6-10(14(18)23)20-21-15(11)22(2)3;1-7(12-8(16)4-5-9(18)13(12)17)24-11-6-10(15(22)23)19-20-14(11)21(2)3;1-7(12-8(15)4-5-9(18)13(12)17)22-10-6-11(16)19-20-14(10)21(2)3;1-5(10-6(13)2-3-7(16)11(10)15)20-8-4-9(14)18-19-12(8)17;6-5-1-3-7-4-2-5;/h6-9H,5H2,1-4H3;4-7H,1-3H3;4-7H,1-3H3,(H,22,23);4-7H,1-3H3;2-5H,1H3,(H2,17,19);1-4H,(H2,6,7);1H4
• InChIKey: IBHWALUZSPIVGA-UHFFFAOYSA-N
• XLogP: 23.02
• TPSA: 333.61 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 26
• Rotatable Bonds: 23
• Heavy Atoms: 124
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1980.47
LogP ≤ 5	23.02
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	26

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'acid_halide', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine?

The IUPAC name of 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine (CID 158648988) is 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine.

What is the SMILES notation for 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine?

The canonical SMILES for 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine is C.CC(Oc1cc(C(=O)Cl)nnc1N(C)C)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(C(=O)O)nnc1N(C)C)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(Cl)nnc1N(C)C)c1c(Cl)ccc(F)c1Cl.CC(Oc1cc(Cl)nnc1N)c1c(Cl)ccc(F)c1Cl.CCOC(=O)c1cc(OC(C)c2c(Cl)ccc(F)c2Cl)c(N(C)C)nn1.Nc1ccncc1.

What is the InChIKey of 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine?

The InChIKey is IBHWALUZSPIVGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18Cl2FN3O3.C15H13Cl3FN3O2.C15H14Cl2FN3O3.C14H13Cl3FN3O.C12H9Cl3FN3O.C5H6N2.CH4/c1-5-25-17(24)12-8-13(16(22-21-12)23(3)4)26-9(2)14-10(18)6-7-11(20)15(14)19;1-7(12-8(16)4-5-9(19)13(12)17)24-11-6-10(14(18)23)20-21-15(11)22(2)3;1-7(12-8(16)4-5-9(18)13(12)17)24-11-6-10(15(22)23)19-20-14(11)21(2)3;1-7(12-8(15)4-5-9(18)13(12)17)22-10-6-11(16)19-20-14(10)21(2)3;1-5(10-6(13)2-3-7(16)11(10)15)20-8-4-9(14)18-19-12(8)17;6-5-1-3-7-4-2-5;/h6-9H,5H2,1-4H3;4-7H,1-3H3;4-7H,1-3H3,(H,22,23);4-7H,1-3H3;2-5H,1H3,(H2,17,19);1-4H,(H2,6,7);1H4.

What are the key properties of 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine?

6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine has a molecular weight of 1980.47 g/mol, XLogP of 23.02, 23 rotatable bonds, 3 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-N,N-dimethylpyridazin-3-amine;6-chloro-4-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]pyridazin-3-amine;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carbonyl chloride;5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylic acid;ethyl 5-[1-(2,6-dichloro-3-fluorophenyl)ethoxy]-6-(dimethylamino)pyridazine-3-carboxylate;methane;pyridin-4-amine is sourced from PubChem (CID 158648988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).