4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine

C117H116F5N37O2 — CID 160560032

About 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine

4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine (PubChem CID 160560032) has the molecular formula C117H116F5N37O2 and a molecular weight of 2167.46 g/mol. Its IUPAC name is 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine.

Molecular Properties

• Compound Name: 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine
• PubChem CID: 160560032
• Molecular Formula: C117H116F5N37O2
• Molecular Weight: 2167.46 g/mol
• Exact Mass: 2166.00
• IUPAC Name: 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine
• SMILES: COc1cc(-c2cc(Nc3nc(N)nc(N4CCCC4c4ccc(F)cc4)n3)n[nH]2)ccc1C.COc1cc(-c2cc(Nc3ncnc(N4CCCC4c4ccc(F)cc4)n3)n[nH]2)ccc1C.Cc1ccc(-c2cc(Nc3ncnc(N4CCCC4c4ccc(F)cc4)n3)n[nH]2)cc1.Cc1cccc(-c2cc(Nc3nc(N)nc(N4CCCC4c4ccc(F)cc4)n3)n[nH]2)c1.Cc1cccc(-c2cc(Nc3ncnc(N4CCCC4c4ccc(F)cc4)n3)n[nH]2)c1
• InChI: InChI=1S/C24H25FN8O.C24H24FN7O.C23H23FN8.2C23H22FN7/c1-14-5-6-16(12-20(14)34-2)18-13-21(32-31-18)27-23-28-22(26)29-24(30-23)33-11-3-4-19(33)15-7-9-17(25)10-8-15;1-15-5-6-17(12-21(15)33-2)19-13-22(31-30-19)28-23-26-14-27-24(29-23)32-11-3-4-20(32)16-7-9-18(25)10-8-16;1-14-4-2-5-16(12-14)18-13-20(31-30-18)26-22-27-21(25)28-23(29-22)32-11-3-6-19(32)15-7-9-17(24)10-8-15;1-15-4-2-5-17(12-15)19-13-21(30-29-19)27-22-25-14-26-23(28-22)31-11-3-6-20(31)16-7-9-18(24)10-8-16;1-15-4-6-16(7-5-15)19-13-21(30-29-19)27-22-25-14-26-23(28-22)31-12-2-3-20(31)17-8-10-18(24)11-9-17/h5-10,12-13,19H,3-4,11H2,1-2H3,(H4,26,27,28,29,30,31,32);5-10,12-14,20H,3-4,11H2,1-2H3,(H2,26,27,28,29,30,31);2,4-5,7-10,12-13,19H,3,6,11H2,1H3,(H4,25,26,27,28,29,30,31);2,4-5,7-10,12-14,20H,3,6,11H2,1H3,(H2,25,26,27,28,29,30);4-11,13-14,20H,2-3,12H2,1H3,(H2,25,26,27,28,29,30)
• InChIKey: QZEKKFQNBUCYCP-UHFFFAOYSA-N
• XLogP: 23.15
• TPSA: 483.60 Ų
• H-Bond Donors: 12
• H-Bond Acceptors: 34
• Rotatable Bonds: 27
• Heavy Atoms: 161
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2167.46
LogP ≤ 5	23.15
H-Bond Donors ≤ 5	12
H-Bond Acceptors ≤ 10	34

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine?

The IUPAC name of 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine (CID 160560032) is 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine.

What is the SMILES notation for 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine?

The canonical SMILES for 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine is COc1cc(-c2cc(Nc3nc(N)nc(N4CCCC4c4ccc(F)cc4)n3)n[nH]2)ccc1C.COc1cc(-c2cc(Nc3ncnc(N4CCCC4c4ccc(F)cc4)n3)n[nH]2)ccc1C.Cc1ccc(-c2cc(Nc3ncnc(N4CCCC4c4ccc(F)cc4)n3)n[nH]2)cc1.Cc1cccc(-c2cc(Nc3nc(N)nc(N4CCCC4c4ccc(F)cc4)n3)n[nH]2)c1.Cc1cccc(-c2cc(Nc3ncnc(N4CCCC4c4ccc(F)cc4)n3)n[nH]2)c1.

What is the InChIKey of 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine?

The InChIKey is QZEKKFQNBUCYCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25FN8O.C24H24FN7O.C23H23FN8.2C23H22FN7/c1-14-5-6-16(12-20(14)34-2)18-13-21(32-31-18)27-23-28-22(26)29-24(30-23)33-11-3-4-19(33)15-7-9-17(25)10-8-15;1-15-5-6-17(12-21(15)33-2)19-13-22(31-30-19)28-23-26-14-27-24(29-23)32-11-3-4-20(32)16-7-9-18(25)10-8-16;1-14-4-2-5-16(12-14)18-13-20(31-30-18)26-22-27-21(25)28-23(29-22)32-11-3-6-19(32)15-7-9-17(24)10-8-15;1-15-4-2-5-17(12-15)19-13-21(30-29-19)27-22-25-14-26-23(28-22)31-11-3-6-20(31)16-7-9-18(24)10-8-16;1-15-4-6-16(7-5-15)19-13-21(30-29-19)27-22-25-14-26-23(28-22)31-12-2-3-20(31)17-8-10-18(24)11-9-17/h5-10,12-13,19H,3-4,11H2,1-2H3,(H4,26,27,28,29,30,31,32);5-10,12-14,20H,3-4,11H2,1-2H3,(H2,26,27,28,29,30,31);2,4-5,7-10,12-13,19H,3,6,11H2,1H3,(H4,25,26,27,28,29,30,31);2,4-5,7-10,12-14,20H,3,6,11H2,1H3,(H2,25,26,27,28,29,30);4-11,13-14,20H,2-3,12H2,1H3,(H2,25,26,27,28,29,30).

What are the key properties of 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine?

4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine has a molecular weight of 2167.46 g/mol, XLogP of 23.15, 27 rotatable bonds, 12 hydrogen bond donors, and 34 hydrogen bond acceptors.

Where does this data come from?

All data for 4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methoxy-4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;4-[2-(4-fluorophenyl)pyrrolidin-1-yl]-N-[5-(4-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazin-2-amine;6-[2-(4-fluorophenyl)pyrrolidin-1-yl]-2-N-[5-(3-methylphenyl)-1H-pyrazol-3-yl]-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 160560032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).