2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine

C58H50Cl3F12IN10 — CID 159797054

About 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine

2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine (PubChem CID 159797054) has the molecular formula C58H50Cl3F12IN10 and a molecular weight of 1348.35 g/mol. Its IUPAC name is 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine.

Molecular Properties

• Compound Name: 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine
• PubChem CID: 159797054
• Molecular Formula: C58H50Cl3F12IN10
• Molecular Weight: 1348.35 g/mol
• Exact Mass: 1346.21
• IUPAC Name: 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine
• SMILES: C1CCNC1.FC(F)(F)c1cc(I)cc(Cl)n1.FC(F)(F)c1cc(N=C(c2ccccc2)c2ccccc2)cc(Cl)n1.Nc1cc(Cl)nc(C(F)(F)F)c1.Nc1cc(N2CCCC2)nc(C(F)(F)F)c1.[H]N=C(c1ccccc1)c1ccccc1
• InChI: InChI=1S/C19H12ClF3N2.C13H11N.C10H12F3N3.C6H2ClF3IN.C6H4ClF3N2.C4H9N/c20-17-12-15(11-16(25-17)19(21,22)23)24-18(13-7-3-1-4-8-13)14-9-5-2-6-10-14;14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;11-10(12,13)8-5-7(14)6-9(15-8)16-3-1-2-4-16;2*7-5-2-3(11)1-4(12-5)6(8,9)10;1-2-4-5-3-1/h1-12H;1-10,14H;5-6H,1-4H2,(H2,14,15);1-2H;1-2H,(H2,11,12);5H,1-4H2
• InChIKey: NJHQGHFRYZJTQS-UHFFFAOYSA-N
• XLogP: 17.37
• TPSA: 155.08 Ų
• H-Bond Donors: 4
• H-Bond Acceptors: 10
• Rotatable Bonds: 6
• Heavy Atoms: 84
• Complexity: —

Lipinski Rule of Five

2 violations

Rule	Value
MW ≤ 500	1348.35
LogP ≤ 5	17.37
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	10

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine?

The IUPAC name of 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine (CID 159797054) is 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine.

What is the SMILES notation for 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine?

The canonical SMILES for 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine is C1CCNC1.FC(F)(F)c1cc(I)cc(Cl)n1.FC(F)(F)c1cc(N=C(c2ccccc2)c2ccccc2)cc(Cl)n1.Nc1cc(Cl)nc(C(F)(F)F)c1.Nc1cc(N2CCCC2)nc(C(F)(F)F)c1.[H]N=C(c1ccccc1)c1ccccc1.

What is the InChIKey of 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine?

The InChIKey is NJHQGHFRYZJTQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClF3N2.C13H11N.C10H12F3N3.C6H2ClF3IN.C6H4ClF3N2.C4H9N/c20-17-12-15(11-16(25-17)19(21,22)23)24-18(13-7-3-1-4-8-13)14-9-5-2-6-10-14;14-13(11-7-3-1-4-8-11)12-9-5-2-6-10-12;11-10(12,13)8-5-7(14)6-9(15-8)16-3-1-2-4-16;2*7-5-2-3(11)1-4(12-5)6(8,9)10;1-2-4-5-3-1/h1-12H;1-10,14H;5-6H,1-4H2,(H2,14,15);1-2H;1-2H,(H2,11,12);5H,1-4H2.

What are the key properties of 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine?

2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine has a molecular weight of 1348.35 g/mol, XLogP of 17.37, 6 rotatable bonds, 4 hydrogen bond donors, and 10 hydrogen bond acceptors.

Where does this data come from?

All data for 2-chloro-4-iodo-6-(trifluoromethyl)pyridine;2-chloro-6-(trifluoromethyl)pyridin-4-amine;N-[2-chloro-6-(trifluoromethyl)-4-pyridinyl]-1,1-diphenylmethanimine;diphenylmethanimine;pyrrolidine;2-pyrrolidin-1-yl-6-(trifluoromethyl)pyridin-4-amine is sourced from PubChem (CID 159797054), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).