4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate

C98H70Cl13F15N14O15 — CID 161184316

About 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate

4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate (PubChem CID 161184316) has the molecular formula C98H70Cl13F15N14O15 and a molecular weight of 2429.58 g/mol. Its IUPAC name is 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate.

Molecular Properties

• Compound Name: 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate
• PubChem CID: 161184316
• Molecular Formula: C98H70Cl13F15N14O15
• Molecular Weight: 2429.58 g/mol
• Exact Mass: 2422.09
• IUPAC Name: 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate
• SMILES: COC(=O)c1nc(-c2c(F)cc(Cl)c(F)c2C)cc(N)c1Cl.COC(=O)c1nc(-c2ccc(C(F)(F)F)c(F)c2C)cc(N)c1Cl.COC(=O)c1nc(-c2ccc(Cl)c(F)c2C)c(Cl)c(N)c1Cl.COC(=O)c1nc(-c2ccc(Cl)c(F)c2C)c(F)c(N)c1Cl.COC(=O)c1nc(-c2ccc(Cl)c(F)c2OC)c(F)c(N)c1Cl.COC(=O)c1nc(-c2ccc(F)c(F)c2C)cc(N)c1Cl.Cc1c(-c2nc(C(=O)O)c(Cl)c(N)c2F)ccc(Cl)c1F
• InChI: InChI=1S/C15H11ClF4N2O2.C14H10Cl3FN2O2.C14H10Cl2F2N2O3.2C14H10Cl2F2N2O2.C14H11ClF2N2O2.C13H8Cl2F2N2O2/c1-6-7(3-4-8(12(6)17)15(18,19)20)10-5-9(21)11(16)13(22-10)14(23)24-2;1-5-6(3-4-7(15)10(5)18)12-8(16)11(19)9(17)13(20-12)14(21)22-2;1-22-13-5(3-4-6(15)8(13)17)11-9(18)10(19)7(16)12(20-11)14(21)23-2;1-5-10(7(17)3-6(15)12(5)18)9-4-8(19)11(16)13(20-9)14(21)22-2;1-5-6(3-4-7(15)9(5)17)12-10(18)11(19)8(16)13(20-12)14(21)22-2;1-6-7(3-4-8(16)12(6)17)10-5-9(18)11(15)13(19-10)14(20)21-2;1-4-5(2-3-6(14)8(4)16)11-9(17)10(18)7(15)12(19-11)13(20)21/h3-5H,1-2H3,(H2,21,22);3-4H,1-2H3,(H2,19,20);3-4H,1-2H3,(H2,19,20);2*3-4H,1-2H3,(H2,19,20);3-5H,1-2H3,(H2,18,19);2-3H,1H3,(H2,18,19)(H,20,21)
• InChIKey: USWORKKRYXTWMW-UHFFFAOYSA-N
• XLogP: 27.77
• TPSA: 476.70 Ų
• H-Bond Donors: 8
• H-Bond Acceptors: 28
• Rotatable Bonds: 15
• Heavy Atoms: 155
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2429.58
LogP ≤ 5	27.77
H-Bond Donors ≤ 5	8
H-Bond Acceptors ≤ 10	28

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '>_2_ester_groups', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_1', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate?

The IUPAC name of 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate (CID 161184316) is 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate.

What is the SMILES notation for 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate?

The canonical SMILES for 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate is COC(=O)c1nc(-c2c(F)cc(Cl)c(F)c2C)cc(N)c1Cl.COC(=O)c1nc(-c2ccc(C(F)(F)F)c(F)c2C)cc(N)c1Cl.COC(=O)c1nc(-c2ccc(Cl)c(F)c2C)c(Cl)c(N)c1Cl.COC(=O)c1nc(-c2ccc(Cl)c(F)c2C)c(F)c(N)c1Cl.COC(=O)c1nc(-c2ccc(Cl)c(F)c2OC)c(F)c(N)c1Cl.COC(=O)c1nc(-c2ccc(F)c(F)c2C)cc(N)c1Cl.Cc1c(-c2nc(C(=O)O)c(Cl)c(N)c2F)ccc(Cl)c1F.

What is the InChIKey of 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate?

The InChIKey is USWORKKRYXTWMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClF4N2O2.C14H10Cl3FN2O2.C14H10Cl2F2N2O3.2C14H10Cl2F2N2O2.C14H11ClF2N2O2.C13H8Cl2F2N2O2/c1-6-7(3-4-8(12(6)17)15(18,19)20)10-5-9(21)11(16)13(22-10)14(23)24-2;1-5-6(3-4-7(15)10(5)18)12-8(16)11(19)9(17)13(20-12)14(21)22-2;1-22-13-5(3-4-6(15)8(13)17)11-9(18)10(19)7(16)12(20-11)14(21)23-2;1-5-10(7(17)3-6(15)12(5)18)9-4-8(19)11(16)13(20-9)14(21)22-2;1-5-6(3-4-7(15)9(5)17)12-10(18)11(19)8(16)13(20-12)14(21)22-2;1-6-7(3-4-8(16)12(6)17)10-5-9(18)11(15)13(19-10)14(20)21-2;1-4-5(2-3-6(14)8(4)16)11-9(17)10(18)7(15)12(19-11)13(20)21/h3-5H,1-2H3,(H2,21,22);3-4H,1-2H3,(H2,19,20);3-4H,1-2H3,(H2,19,20);2*3-4H,1-2H3,(H2,19,20);3-5H,1-2H3,(H2,18,19);2-3H,1H3,(H2,18,19)(H,20,21).

What are the key properties of 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate?

4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate has a molecular weight of 2429.58 g/mol, XLogP of 27.77, 15 rotatable bonds, 8 hydrogen bond donors, and 28 hydrogen bond acceptors.

Where does this data come from?

All data for 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methoxyphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(4-chloro-3-fluoro-2-methylphenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate is sourced from PubChem (CID 161184316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).