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

C83H62Cl9F12N15O13 — CID 159348278

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

4-amino-3-chloro-6-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate (PubChem CID 159348278) has the molecular formula C83H62Cl9F12N15O13 and a molecular weight of 2024.55 g/mol. Its IUPAC name is 4-amino-3-chloro-6-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]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-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate
• PubChem CID: 159348278
• Molecular Formula: C83H62Cl9F12N15O13
• Molecular Weight: 2024.55 g/mol
• Exact Mass: 2019.17
• IUPAC Name: 4-amino-3-chloro-6-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate
• SMILES: COC(=O)c1nc(-c2ccc(C(F)(F)F)nc2)cc(N)c1Cl.COC(=O)c1nc(-c2ccc(C(F)(F)F)nc2OC)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(F)c(F)c2C)cc(N)c1Cl.Nc1c(F)c(-c2ccc(C3CC3)nc2)nc(C(=O)O)c1Cl
• InChI: InChI=1S/C14H10Cl3FN2O2.C14H10Cl2F2N2O2.C14H11ClF3N3O3.C14H11ClF2N2O2.C14H11ClFN3O2.C13H9ClF3N3O2/c1-5-6(3-4-7(15)10(5)18)12-8(16)11(19)9(17)13(20-12)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;1-23-12-6(3-4-9(21-12)14(16,17)18)8-5-7(19)10(15)11(20-8)13(22)24-2;1-6-7(3-4-8(16)12(6)17)10-5-9(18)11(15)13(19-10)14(20)21-2;15-9-11(17)10(16)12(19-13(9)14(20)21)7-3-4-8(18-5-7)6-1-2-6;1-22-12(21)11-10(14)7(18)4-8(20-11)6-2-3-9(19-5-6)13(15,16)17/h2*3-4H,1-2H3,(H2,19,20);3-5H,1-2H3,(H2,19,20);3-5H,1-2H3,(H2,18,19);3-6H,1-2H2,(H2,17,19)(H,20,21);2-5H,1H3,(H2,18,20)
• InChIKey: LGZSQKWOYUHDIC-UHFFFAOYSA-N
• XLogP: 21.37
• TPSA: 450.16 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 27
• Rotatable Bonds: 14
• Heavy Atoms: 132
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2024.55
LogP ≤ 5	21.37
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	27

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-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]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-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate (CID 159348278) is 4-amino-3-chloro-6-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]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-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]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-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate is COC(=O)c1nc(-c2ccc(C(F)(F)F)nc2)cc(N)c1Cl.COC(=O)c1nc(-c2ccc(C(F)(F)F)nc2OC)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(F)c(F)c2C)cc(N)c1Cl.Nc1c(F)c(-c2ccc(C3CC3)nc2)nc(C(=O)O)c1Cl.

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

The InChIKey is LGZSQKWOYUHDIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10Cl3FN2O2.C14H10Cl2F2N2O2.C14H11ClF3N3O3.C14H11ClF2N2O2.C14H11ClFN3O2.C13H9ClF3N3O2/c1-5-6(3-4-7(15)10(5)18)12-8(16)11(19)9(17)13(20-12)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;1-23-12-6(3-4-9(21-12)14(16,17)18)8-5-7(19)10(15)11(20-8)13(22)24-2;1-6-7(3-4-8(16)12(6)17)10-5-9(18)11(15)13(19-10)14(20)21-2;15-9-11(17)10(16)12(19-13(9)14(20)21)7-3-4-8(18-5-7)6-1-2-6;1-22-12(21)11-10(14)7(18)4-8(20-11)6-2-3-9(19-5-6)13(15,16)17/h2*3-4H,1-2H3,(H2,19,20);3-5H,1-2H3,(H2,19,20);3-5H,1-2H3,(H2,18,19);3-6H,1-2H2,(H2,17,19)(H,20,21);2-5H,1H3,(H2,18,20).

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

4-amino-3-chloro-6-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate has a molecular weight of 2024.55 g/mol, XLogP of 21.37, 14 rotatable bonds, 7 hydrogen bond donors, and 27 hydrogen bond acceptors.

Where does this data come from?

All data for 4-amino-3-chloro-6-(6-cyclopropyl-3-pyridinyl)-5-fluoropyridine-2-carboxylic acid;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-[2-methoxy-6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[6-(trifluoromethyl)-3-pyridinyl]pyridine-2-carboxylate;methyl 4-amino-3,5-dichloro-6-(4-chloro-3-fluoro-2-methylphenyl)pyridine-2-carboxylate is sourced from PubChem (CID 159348278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).