3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide

C147H111Cl2F19N34O12S2 — CID 158891620

About 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide

3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide (PubChem CID 158891620) has the molecular formula C147H111Cl2F19N34O12S2 and a molecular weight of 3041.73 g/mol. Its IUPAC name is 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide.

Molecular Properties

• Compound Name: 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide
• PubChem CID: 158891620
• Molecular Formula: C147H111Cl2F19N34O12S2
• Molecular Weight: 3041.73 g/mol
• Exact Mass: 3038.76
• IUPAC Name: 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide
• SMILES: Cc1ccc(Cn2nc(NC(=O)c3ccno3)c3ccccc32)cc1.Cc1cnoc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.Cc1nocc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cncs1.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cnon1.O=C(Nc1nn(Cc2ccc(F)cc2)c2ccccc12)c1ccno1.[H]/N=C(\N)c1c(Cl)cncc1NCc1ccc(C(F)(F)F)cc1.[H]/N=C(\NC(=O)c1scnc1C)c1c(Cl)cncc1NCc1ccc(C(F)(F)F)cc1
• InChI: InChI=1S/2C20H15F3N4O2.C19H15ClF3N5OS.C19H13F3N4OS.C19H16N4O2.C18H12F3N5O2.C18H13FN4O2.C14H12ClF3N4/c1-12-16(11-29-26-12)19(28)24-18-15-4-2-3-5-17(15)27(25-18)10-13-6-8-14(9-7-13)20(21,22)23;1-12-10-24-29-17(12)19(28)25-18-15-4-2-3-5-16(15)27(26-18)11-13-6-8-14(9-7-13)20(21,22)23;1-10-16(30-9-27-10)18(29)28-17(24)15-13(20)7-25-8-14(15)26-6-11-2-4-12(5-3-11)19(21,22)23;20-19(21,22)13-7-5-12(6-8-13)10-26-15-4-2-1-3-14(15)17(25-26)24-18(27)16-9-23-11-28-16;1-13-6-8-14(9-7-13)12-23-16-5-3-2-4-15(16)18(22-23)21-19(24)17-10-11-20-25-17;19-18(20,21)12-7-5-11(6-8-12)10-26-15-4-2-1-3-13(15)16(24-26)23-17(27)14-9-22-28-25-14;19-13-7-5-12(6-8-13)11-23-15-4-2-1-3-14(15)17(22-23)21-18(24)16-9-10-20-25-16;15-10-6-21-7-11(12(10)13(19)20)22-5-8-1-3-9(4-2-8)14(16,17)18/h2-9,11H,10H2,1H3,(H,24,25,28);2-10H,11H2,1H3,(H,25,26,28);2-5,7-9,26H,6H2,1H3,(H2,24,28,29);1-9,11H,10H2,(H,24,25,27);2-11H,12H2,1H3,(H,21,22,24);1-9H,10H2,(H,23,24,27);1-10H,11H2,(H,21,22,24);1-4,6-7,22H,5H2,(H3,19,20)
• InChIKey: JEHQJPOOKAOTEP-UHFFFAOYSA-N
• XLogP: 33.49
• TPSA: 603.00 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 40
• Rotatable Bonds: 33
• Heavy Atoms: 216
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	3041.73
LogP ≤ 5	33.49
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	40

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide?

The IUPAC name of 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide (CID 158891620) is 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide.

What is the SMILES notation for 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide?

The canonical SMILES for 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide is Cc1ccc(Cn2nc(NC(=O)c3ccno3)c3ccccc32)cc1.Cc1cnoc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.Cc1nocc1C(=O)Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cncs1.O=C(Nc1nn(Cc2ccc(C(F)(F)F)cc2)c2ccccc12)c1cnon1.O=C(Nc1nn(Cc2ccc(F)cc2)c2ccccc12)c1ccno1.[H]/N=C(\N)c1c(Cl)cncc1NCc1ccc(C(F)(F)F)cc1.[H]/N=C(\NC(=O)c1scnc1C)c1c(Cl)cncc1NCc1ccc(C(F)(F)F)cc1.

What is the InChIKey of 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide?

The InChIKey is JEHQJPOOKAOTEP-UHFFFAOYSA-N. The full InChI is InChI=1S/2C20H15F3N4O2.C19H15ClF3N5OS.C19H13F3N4OS.C19H16N4O2.C18H12F3N5O2.C18H13FN4O2.C14H12ClF3N4/c1-12-16(11-29-26-12)19(28)24-18-15-4-2-3-5-17(15)27(25-18)10-13-6-8-14(9-7-13)20(21,22)23;1-12-10-24-29-17(12)19(28)25-18-15-4-2-3-5-16(15)27(26-18)11-13-6-8-14(9-7-13)20(21,22)23;1-10-16(30-9-27-10)18(29)28-17(24)15-13(20)7-25-8-14(15)26-6-11-2-4-12(5-3-11)19(21,22)23;20-19(21,22)13-7-5-12(6-8-13)10-26-15-4-2-1-3-14(15)17(25-26)24-18(27)16-9-23-11-28-16;1-13-6-8-14(9-7-13)12-23-16-5-3-2-4-15(16)18(22-23)21-19(24)17-10-11-20-25-17;19-18(20,21)12-7-5-11(6-8-12)10-26-15-4-2-1-3-13(15)16(24-26)23-17(27)14-9-22-28-25-14;19-13-7-5-12(6-8-13)11-23-15-4-2-1-3-14(15)17(22-23)21-18(24)16-9-10-20-25-16;15-10-6-21-7-11(12(10)13(19)20)22-5-8-1-3-9(4-2-8)14(16,17)18/h2-9,11H,10H2,1H3,(H,24,25,28);2-10H,11H2,1H3,(H,25,26,28);2-5,7-9,26H,6H2,1H3,(H2,24,28,29);1-9,11H,10H2,(H,24,25,27);2-11H,12H2,1H3,(H,21,22,24);1-9H,10H2,(H,23,24,27);1-10H,11H2,(H,21,22,24);1-4,6-7,22H,5H2,(H3,19,20).

What are the key properties of 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide?

3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide has a molecular weight of 3041.73 g/mol, XLogP of 33.49, 33 rotatable bonds, 12 hydrogen bond donors, and 40 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidamide;N-[3-chloro-5-[[4-(trifluoromethyl)phenyl]methylamino]pyridine-4-carboximidoyl]-4-methyl-1,3-thiazole-5-carboxamide;N-[1-[(4-fluorophenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[(4-methylphenyl)methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;3-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-4-carboxamide;4-methyl-N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2-oxazole-5-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,2,5-oxadiazole-3-carboxamide;N-[1-[[4-(trifluoromethyl)phenyl]methyl]indazol-3-yl]-1,3-thiazole-5-carboxamide is sourced from PubChem (CID 158891620), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).