4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate

C81H60Cl11F8N13O14 — CID 159144893

About 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate

4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate (PubChem CID 159144893) has the molecular formula C81H60Cl11F8N13O14 and a molecular weight of 1981.41 g/mol. Its IUPAC name is 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate.

Molecular Properties

• Compound Name: 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate
• PubChem CID: 159144893
• Molecular Formula: C81H60Cl11F8N13O14
• Molecular Weight: 1981.41 g/mol
• Exact Mass: 1975.08
• IUPAC Name: 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate
• SMILES: CCc1c(-c2cc(N)c(Cl)c(C(=O)OC)n2)ccc(Cl)c1F.COC(=O)c1nc(-c2ccc(Cl)c(F)c2C(F)F)cc(N)c1Cl.COC(=O)c1nc(-c2ccc(Cl)c(F)c2OC)cc(N)c1Cl.COc1c(-c2cc(N)c(Cl)c(C(=O)O)n2)ccc(Cl)c1F.Cc1c(-c2cc(N)c(Cl)c(C(=O)O)n2)ccc(Cl)c1F.Cc1ccc(-c2nc(C(=O)O)c(Cl)c(N)c2F)cn1
• InChI: InChI=1S/C15H13Cl2FN2O2.C14H9Cl2F3N2O2.C14H11Cl2FN2O3.C13H9Cl2FN2O3.C13H9Cl2FN2O2.C12H9ClFN3O2/c1-3-7-8(4-5-9(16)13(7)18)11-6-10(19)12(17)14(20-11)15(21)22-2;1-23-14(22)12-10(16)7(20)4-8(21-12)5-2-3-6(15)11(17)9(5)13(18)19;1-21-13-6(3-4-7(15)11(13)17)9-5-8(18)10(16)12(19-9)14(20)22-2;1-21-12-5(2-3-6(14)10(12)16)8-4-7(17)9(15)11(18-8)13(19)20;1-5-6(2-3-7(14)11(5)16)9-4-8(17)10(15)12(18-9)13(19)20;1-5-2-3-6(4-16-5)10-8(14)9(15)7(13)11(17-10)12(18)19/h4-6H,3H2,1-2H3,(H2,19,20);2-4,13H,1H3,(H2,20,21);3-5H,1-2H3,(H2,18,19);2-4H,1H3,(H2,17,18)(H,19,20);2-4H,1H3,(H2,17,18)(H,19,20);2-4H,1H3,(H2,15,17)(H,18,19)
• InChIKey: KIOBXFDOXMIXCW-UHFFFAOYSA-N
• XLogP: 21.99
• TPSA: 455.61 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 24
• Rotatable Bonds: 16
• Heavy Atoms: 127
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1981.41
LogP ≤ 5	21.99
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	24

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate?

The IUPAC name of 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate (CID 159144893) is 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate.

What is the SMILES notation for 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate?

The canonical SMILES for 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate is CCc1c(-c2cc(N)c(Cl)c(C(=O)OC)n2)ccc(Cl)c1F.COC(=O)c1nc(-c2ccc(Cl)c(F)c2C(F)F)cc(N)c1Cl.COC(=O)c1nc(-c2ccc(Cl)c(F)c2OC)cc(N)c1Cl.COc1c(-c2cc(N)c(Cl)c(C(=O)O)n2)ccc(Cl)c1F.Cc1c(-c2cc(N)c(Cl)c(C(=O)O)n2)ccc(Cl)c1F.Cc1ccc(-c2nc(C(=O)O)c(Cl)c(N)c2F)cn1.

What is the InChIKey of 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate?

The InChIKey is KIOBXFDOXMIXCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13Cl2FN2O2.C14H9Cl2F3N2O2.C14H11Cl2FN2O3.C13H9Cl2FN2O3.C13H9Cl2FN2O2.C12H9ClFN3O2/c1-3-7-8(4-5-9(16)13(7)18)11-6-10(19)12(17)14(20-11)15(21)22-2;1-23-14(22)12-10(16)7(20)4-8(21-12)5-2-3-6(15)11(17)9(5)13(18)19;1-21-13-6(3-4-7(15)11(13)17)9-5-8(18)10(16)12(19-9)14(20)22-2;1-21-12-5(2-3-6(14)10(12)16)8-4-7(17)9(15)11(18-8)13(19)20;1-5-6(2-3-7(14)11(5)16)9-4-8(17)10(15)12(18-9)13(19)20;1-5-2-3-6(4-16-5)10-8(14)9(15)7(13)11(17-10)12(18)19/h4-6H,3H2,1-2H3,(H2,19,20);2-4,13H,1H3,(H2,20,21);3-5H,1-2H3,(H2,18,19);2-4H,1H3,(H2,17,18)(H,19,20);2-4H,1H3,(H2,17,18)(H,19,20);2-4H,1H3,(H2,15,17)(H,18,19).

What are the key properties of 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate?

4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate has a molecular weight of 1981.41 g/mol, XLogP of 21.99, 16 rotatable bonds, 9 hydrogen bond donors, and 24 hydrogen bond acceptors.

Where does this data come from?

All data for 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-5-fluoro-6-(6-methyl-3-pyridinyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-fluorophenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-2-ethyl-3-fluorophenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)pyridine-2-carboxylate is sourced from PubChem (CID 159144893), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).