6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine

C105H110Cl3FN36O — CID 161219155

About 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine

6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine (PubChem CID 161219155) has the molecular formula C105H110Cl3FN36O and a molecular weight of 2017.64 g/mol. Its IUPAC name is 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

• Compound Name: 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine
• PubChem CID: 161219155
• Molecular Formula: C105H110Cl3FN36O
• Molecular Weight: 2017.64 g/mol
• Exact Mass: 2014.87
• IUPAC Name: 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine
• SMILES: CC(C)Nc1nc(Nc2ccccc2)nc(-c2cc(Cl)ccn2)n1.CC(C)Nc1nc(Nc2ccccc2)nc(-c2cccc(Cl)n2)n1.CC(C)Nc1nc(Nc2ccncc2)nc(-c2ccccc2Cl)n1.CC(C)Nc1nc(Nc2ccncc2)nc(-c2ccccc2F)n1.CCNc1cc(Nc2nc(NC(C)C)nc(-c3ccccc3)n2)ccn1.COCCNc1nc(Nc2ccccc2)nc(-c2ccccc2)n1
• InChI: InChI=1S/C19H23N7.C18H19N5O.3C17H17ClN6.C17H17FN6/c1-4-20-16-12-15(10-11-21-16)23-19-25-17(14-8-6-5-7-9-14)24-18(26-19)22-13(2)3;1-24-13-12-19-17-21-16(14-8-4-2-5-9-14)22-18(23-17)20-15-10-6-3-7-11-15;1-11(2)19-16-22-15(13-9-6-10-14(18)21-13)23-17(24-16)20-12-7-4-3-5-8-12;1-11(2)20-16-22-15(13-5-3-4-6-14(13)18)23-17(24-16)21-12-7-9-19-10-8-12;1-11(2)20-16-22-15(14-10-12(18)8-9-19-14)23-17(24-16)21-13-6-4-3-5-7-13;1-11(2)20-16-22-15(13-5-3-4-6-14(13)18)23-17(24-16)21-12-7-9-19-10-8-12/h5-13H,4H2,1-3H3,(H3,20,21,22,23,24,25,26);2-11H,12-13H2,1H3,(H2,19,20,21,22,23);3-11H,1-2H3,(H2,19,20,22,23,24);3-11H,1-2H3,(H2,19,20,21,22,23,24);3-11H,1-2H3,(H2,20,21,22,23,24);3-11H,1-2H3,(H2,19,20,21,22,23,24)
• InChIKey: UXGRMFNWAPENGK-UHFFFAOYSA-N
• XLogP: 23.36
• TPSA: 462.09 Ų
• H-Bond Donors: 13
• H-Bond Acceptors: 37
• Rotatable Bonds: 34
• Heavy Atoms: 146
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2017.64
LogP ≤ 5	23.36
H-Bond Donors ≤ 5	13
H-Bond Acceptors ≤ 10	37

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine?

The IUPAC name of 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine (CID 161219155) is 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine.

What is the SMILES notation for 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine?

The canonical SMILES for 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine is CC(C)Nc1nc(Nc2ccccc2)nc(-c2cc(Cl)ccn2)n1.CC(C)Nc1nc(Nc2ccccc2)nc(-c2cccc(Cl)n2)n1.CC(C)Nc1nc(Nc2ccncc2)nc(-c2ccccc2Cl)n1.CC(C)Nc1nc(Nc2ccncc2)nc(-c2ccccc2F)n1.CCNc1cc(Nc2nc(NC(C)C)nc(-c3ccccc3)n2)ccn1.COCCNc1nc(Nc2ccccc2)nc(-c2ccccc2)n1.

What is the InChIKey of 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine?

The InChIKey is UXGRMFNWAPENGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N7.C18H19N5O.3C17H17ClN6.C17H17FN6/c1-4-20-16-12-15(10-11-21-16)23-19-25-17(14-8-6-5-7-9-14)24-18(26-19)22-13(2)3;1-24-13-12-19-17-21-16(14-8-4-2-5-9-14)22-18(23-17)20-15-10-6-3-7-11-15;1-11(2)19-16-22-15(13-9-6-10-14(18)21-13)23-17(24-16)20-12-7-4-3-5-8-12;1-11(2)20-16-22-15(13-5-3-4-6-14(13)18)23-17(24-16)21-12-7-9-19-10-8-12;1-11(2)20-16-22-15(14-10-12(18)8-9-19-14)23-17(24-16)21-13-6-4-3-5-7-13;1-11(2)20-16-22-15(13-5-3-4-6-14(13)18)23-17(24-16)21-12-7-9-19-10-8-12/h5-13H,4H2,1-3H3,(H3,20,21,22,23,24,25,26);2-11H,12-13H2,1H3,(H2,19,20,21,22,23);3-11H,1-2H3,(H2,19,20,22,23,24);3-11H,1-2H3,(H2,19,20,21,22,23,24);3-11H,1-2H3,(H2,20,21,22,23,24);3-11H,1-2H3,(H2,19,20,21,22,23,24).

What are the key properties of 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine?

6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine has a molecular weight of 2017.64 g/mol, XLogP of 23.36, 34 rotatable bonds, 13 hydrogen bond donors, and 37 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(2-chlorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;6-(4-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(6-chloro-2-pyridinyl)-4-N-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;4-N-[2-(ethylamino)-4-pyridinyl]-6-phenyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine;6-(2-fluorophenyl)-2-N-propan-2-yl-4-N-pyridin-4-yl-1,3,5-triazine-2,4-diamine;4-N-(2-methoxyethyl)-2-N,6-diphenyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 161219155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).