4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid

C60H43Cl3F12N10O15 — CID 161437147

IUPAC4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid
SMILESCOc1c(C(=O)O)nc(-c2ccc(C(F)(F)F)cc2)c(F)c1N.COc1c(C(=O)O)nc(-c2ccc(Cl)c(F)c2)c(F)c1N.COc1c(C(=O)O)nc(-c2ccc(Cl)c(F)c2F)c(F)c1N.COc1c(C(=O)O)nc(-c2ccc(F)cc2)c(F)c1N.COc1c(C(=O)O)nc(Cl)c(F)c1N
InChIInChI=1S/C14H10F4N2O3.C13H8ClF3N2O3.C13H9ClF2N2O3.C13H10F2N2O3.C7H6ClFN2O3/c1-23-12-9(19)8(15)10(20-11(12)13(21)22)6-2-4-7(5-3-6)14(16,17)18;1-22-12-9(18)8(17)10(19-11(12)13(20)21)4-2-3-5(14)7(16)6(4)15;1-21-12-9(17)8(16)10(18-11(12)13(19)20)5-2-3-6(14)7(15)4-5;1-20-12-9(16)8(15)10(17-11(12)13(18)19)6-2-4-7(14)5-3-6;1-14-5-3(10)2(9)6(8)11-4(5)7(12)13/h2-5H,1H3,(H2,19,20)(H,21,22);2-3H,1H3,(H2,18,19)(H,20,21);2-4H,1H3,(H2,17,18)(H,19,20);2-5H,1H3,(H2,16,17)(H,18,19);1H3,(H2,10,11)(H,12,13)
InChIKeyVYUIILXJSHNXHF-UHFFFAOYSA-N
MW1478.39 g/mol
LogP12.75
Rot. Bonds14

About 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid

4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid (PubChem CID 161437147) has the molecular formula C60H43Cl3F12N10O15 and a molecular weight of 1478.39 g/mol. Its IUPAC name is 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid.

Molecular Properties

Compound Name4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid
PubChem CID161437147
Molecular FormulaC60H43Cl3F12N10O15
Molecular Weight1478.39 g/mol
Exact Mass1476.18
IUPAC Name4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid
SMILESCOc1c(C(=O)O)nc(-c2ccc(C(F)(F)F)cc2)c(F)c1N.COc1c(C(=O)O)nc(-c2ccc(Cl)c(F)c2)c(F)c1N.COc1c(C(=O)O)nc(-c2ccc(Cl)c(F)c2F)c(F)c1N.COc1c(C(=O)O)nc(-c2ccc(F)cc2)c(F)c1N.COc1c(C(=O)O)nc(Cl)c(F)c1N
InChIInChI=1S/C14H10F4N2O3.C13H8ClF3N2O3.C13H9ClF2N2O3.C13H10F2N2O3.C7H6ClFN2O3/c1-23-12-9(19)8(15)10(20-11(12)13(21)22)6-2-4-7(5-3-6)14(16,17)18;1-22-12-9(18)8(17)10(19-11(12)13(20)21)4-2-3-5(14)7(16)6(4)15;1-21-12-9(17)8(16)10(18-11(12)13(19)20)5-2-3-6(14)7(15)4-5;1-20-12-9(16)8(15)10(17-11(12)13(18)19)6-2-4-7(14)5-3-6;1-14-5-3(10)2(9)6(8)11-4(5)7(12)13/h2-5H,1H3,(H2,19,20)(H,21,22);2-3H,1H3,(H2,18,19)(H,20,21);2-4H,1H3,(H2,17,18)(H,19,20);2-5H,1H3,(H2,16,17)(H,18,19);1H3,(H2,10,11)(H,12,13)
InChIKeyVYUIILXJSHNXHF-UHFFFAOYSA-N
XLogP12.75
TPSA427.20 Ų
H-Bond Donors10
H-Bond Acceptors20
Rotatable Bonds14
Heavy Atoms100
Complexity—

Lipinski Rule of Five

4 violations

RuleValue
MW ≤ 5001478.39
LogP ≤ 512.75
H-Bond Donors ≤ 510
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'halogenated_ring_2', 'substructure': 'N/A'}

Analyze 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-Amino-6-(4-chlorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid
CID 71175272
4-Amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid
CID 71175273
4-Amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid
CID 71175278
4-Amino-6-(4-chloro-2-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid
CID 71175290
4-Amino-6-chloro-5-fluoro-3-methylsulfanylpyridine-2-carboxylic acid;4-amino-6-(4-chloro-2-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methylsulfanylpyridine-2-carboxylic acid;4-amino-6-(4-chloro-2-fluorophenyl)-3-(2,2,2-trifluoroethoxy)pyridine-2-carboxylic acid;methyl 4-amino-6-chloro-5-fluoro-3-methylsulfanylpyridine-2-carboxylate;methyl 4-amino-6-(4-chloro-2-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylate
CID 158039477
Methyl 4-amino-6-[4-chloro-2-fluoro-3-(1-fluoroethyl)phenyl]-5-fluoro-3-methoxypyridine-2-carboxylate;methyl 4-amino-6-(4-chloro-2-fluoro-3-methoxyphenyl)-5-fluoro-3-methoxypyridine-2-carboxylate;methyl 4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylate;methyl 4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate
CID 158537189
4-Amino-3-chloro-6-(4-ethynylphenyl)-5-fluoropyridine-2-carboxylic acid;4-amino-6-[2,3-difluoro-4-(trifluoromethyl)phenyl]-3-ethenyl-5-fluoropyridine-2-carboxylic acid;6-amino-2-[3-fluoro-4-(trifluoromethyl)phenyl]-5-methoxypyrimidine-4-carboxylic acid;methyl 4-amino-3,5-dichloro-6-[3-fluoro-4-(trifluoromethyl)phenyl]pyridine-2-carboxylate;methyl 4-amino-3-ethenyl-6-(4-ethynylphenyl)-5-fluoropyridine-2-carboxylate;methyl 6-amino-2-(4-ethynyl-2-fluorophenyl)-5-methoxypyrimidine-4-carboxylate
CID 159055353
Methyl 4-amino-6-(1,3-benzodioxol-5-yl)-5-fluoro-3-methoxypyridine-2-carboxylate;methyl 4-amino-6-[4-chloro-2-fluoro-3-(1-fluoroethyl)phenyl]-5-fluoro-3-methoxypyridine-2-carboxylate;methyl 4-amino-6-(4-chloro-2-fluoro-3-methoxyphenyl)-5-fluoro-3-methoxypyridine-2-carboxylate;methyl 4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylate;methyl 4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylate
CID 159149528
4-Amino-3-chloro-6-(2,3-difluoro-4-iodophenyl)-5-fluoropyridine-2-carboxylic acid;4-amino-3-chloro-6-[4-(difluoromethoxy)-2-fluorophenyl]-5-fluoropyridine-2-carboxylic acid;4-amino-3-chloro-6-[4-(difluoromethoxy)phenyl]-5-fluoropyridine-2-carboxylic acid;4-amino-3,5-dichloro-6-(3-fluoro-4-iodophenyl)pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-(4-cyanophenyl)-5-fluoropyridine-2-carboxylate;methyl 4-amino-3-chloro-6-[2,5-difluoro-4-(trifluoromethyl)phenyl]-5-fluoropyridine-2-carboxylate
CID 159262336
Ethyl 4-amino-6-(4-chloro-2-fluorophenyl)-3-(2,2,2-trifluoroethylsulfanyl)pyridine-2-carboxylate;methyl 4-amino-6-(4-chloro-2-fluoro-3-methoxyphenyl)-5-fluoro-3-methylsulfanylpyridine-2-carboxylate;methyl 4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methylsulfanylpyridine-2-carboxylate;methyl 4-amino-6-(difluoromethyl)-3-methoxypyridine-2-carboxylate
CID 159276046
4-Amino-5-fluoro-6-[3-fluoro-4-(trifluoromethyl)phenyl]-3-methoxypyridine-2-carboxylic acid;methyl 4-amino-6-(4-chloro-2-fluoro-3-methoxyphenyl)-3-(difluoromethoxy)pyridine-2-carboxylate;methyl 4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylate;methyl 4-amino-6-ethenyl-5-fluoro-3-methoxypyridine-2-carboxylate
CID 159389179
4-Amino-3-chloro-6-(4-chloro-3,6-difluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(4-chloro-2-ethenyl-3-fluorophenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-(3,4-difluoro-2-methylphenyl)pyridine-2-carboxylic acid;4-amino-3-chloro-6-[3-fluoro-2-methyl-4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid;methyl 4-amino-3-chloro-6-[4-chloro-2-(difluoromethyl)-3-methoxyphenyl]pyridine-2-carboxylate;methyl 4-amino-3-chloro-6-(3-fluoro-4-iodo-2-methylphenyl)pyridine-2-carboxylate
CID 160010637

Frequently Asked Questions

What is the IUPAC name of 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid?
The IUPAC name of 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid (CID 161437147) is 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid.
What is the SMILES notation for 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid?
The canonical SMILES for 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid is COc1c(C(=O)O)nc(-c2ccc(C(F)(F)F)cc2)c(F)c1N.COc1c(C(=O)O)nc(-c2ccc(Cl)c(F)c2)c(F)c1N.COc1c(C(=O)O)nc(-c2ccc(Cl)c(F)c2F)c(F)c1N.COc1c(C(=O)O)nc(-c2ccc(F)cc2)c(F)c1N.COc1c(C(=O)O)nc(Cl)c(F)c1N.
What is the InChIKey of 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid?
The InChIKey is VYUIILXJSHNXHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10F4N2O3.C13H8ClF3N2O3.C13H9ClF2N2O3.C13H10F2N2O3.C7H6ClFN2O3/c1-23-12-9(19)8(15)10(20-11(12)13(21)22)6-2-4-7(5-3-6)14(16,17)18;1-22-12-9(18)8(17)10(19-11(12)13(20)21)4-2-3-5(14)7(16)6(4)15;1-21-12-9(17)8(16)10(18-11(12)13(19)20)5-2-3-6(14)7(15)4-5;1-20-12-9(16)8(15)10(17-11(12)13(18)19)6-2-4-7(14)5-3-6;1-14-5-3(10)2(9)6(8)11-4(5)7(12)13/h2-5H,1H3,(H2,19,20)(H,21,22);2-3H,1H3,(H2,18,19)(H,20,21);2-4H,1H3,(H2,17,18)(H,19,20);2-5H,1H3,(H2,16,17)(H,18,19);1H3,(H2,10,11)(H,12,13).
What are the key properties of 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid?
4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid has a molecular weight of 1478.39 g/mol, XLogP of 12.75, 14 rotatable bonds, 10 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-6-(4-chloro-2,3-difluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-chloro-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-6-(4-chloro-3-fluorophenyl)-5-fluoro-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-6-(4-fluorophenyl)-3-methoxypyridine-2-carboxylic acid;4-amino-5-fluoro-3-methoxy-6-[4-(trifluoromethyl)phenyl]pyridine-2-carboxylic acid is sourced from PubChem (CID 161437147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).