2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine

C88H137Cl7N26O4 — CID 159288325

About 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine

2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine (PubChem CID 159288325) has the molecular formula C88H137Cl7N26O4 and a molecular weight of 1871.41 g/mol. Its IUPAC name is 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine.

Molecular Properties

• Compound Name: 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine
• PubChem CID: 159288325
• Molecular Formula: C88H137Cl7N26O4
• Molecular Weight: 1871.41 g/mol
• Exact Mass: 1866.91
• IUPAC Name: 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine
• SMILES: CCCCN(CCC)c1nc(Cl)nc(Nc2ccc(OC)c(Cl)c2)n1.CCCCN(CCC)c1nc(Nc2ccc(OC)c(Cl)c2)nc(N(C)C2CCN(C)CC2)n1.CCCCN(CCC)c1nc(Nc2ccc(OC)c(Cl)c2)nc(N(C)C2CCNCC2)n1.CCCCNCCC.CNC1CCN(C)CC1.COc1ccc(Nc2nc(Cl)nc(Cl)n2)cc1Cl
• InChI: InChI=1S/C24H38ClN7O.C23H36ClN7O.C17H23Cl2N5O.C10H7Cl3N4O.C7H16N2.C7H17N/c1-6-8-14-32(13-7-2)24-28-22(26-18-9-10-21(33-5)20(25)17-18)27-23(29-24)31(4)19-11-15-30(3)16-12-19;1-5-7-15-31(14-6-2)23-28-21(26-17-8-9-20(32-4)19(24)16-17)27-22(29-23)30(3)18-10-12-25-13-11-18;1-4-6-10-24(9-5-2)17-22-15(19)21-16(23-17)20-12-7-8-14(25-3)13(18)11-12;1-18-7-3-2-5(4-6(7)11)14-10-16-8(12)15-9(13)17-10;1-8-7-3-5-9(2)6-4-7;1-3-5-7-8-6-4-2/h9-10,17,19H,6-8,11-16H2,1-5H3,(H,26,27,28,29);8-9,16,18,25H,5-7,10-15H2,1-4H3,(H,26,27,28,29);7-8,11H,4-6,9-10H2,1-3H3,(H,20,21,22,23);2-4H,1H3,(H,14,15,16,17);7-8H,3-6H2,1-2H3;8H,3-7H2,1-2H3
• InChIKey: KZUGBNQFTNYYKJ-UHFFFAOYSA-N
• XLogP: 19.92
• TPSA: 298.49 Ų
• H-Bond Donors: 7
• H-Bond Acceptors: 30
• Rotatable Bonds: 40
• Heavy Atoms: 125
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1871.41
LogP ≤ 5	19.92
H-Bond Donors ≤ 5	7
H-Bond Acceptors ≤ 10	30

Computed Properties (RDKit)

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

Frequently Asked Questions

What is the IUPAC name of 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine?

The IUPAC name of 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine (CID 159288325) is 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine.

What is the SMILES notation for 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine?

The canonical SMILES for 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine is CCCCN(CCC)c1nc(Cl)nc(Nc2ccc(OC)c(Cl)c2)n1.CCCCN(CCC)c1nc(Nc2ccc(OC)c(Cl)c2)nc(N(C)C2CCN(C)CC2)n1.CCCCN(CCC)c1nc(Nc2ccc(OC)c(Cl)c2)nc(N(C)C2CCNCC2)n1.CCCCNCCC.CNC1CCN(C)CC1.COc1ccc(Nc2nc(Cl)nc(Cl)n2)cc1Cl.

What is the InChIKey of 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine?

The InChIKey is KZUGBNQFTNYYKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H38ClN7O.C23H36ClN7O.C17H23Cl2N5O.C10H7Cl3N4O.C7H16N2.C7H17N/c1-6-8-14-32(13-7-2)24-28-22(26-18-9-10-21(33-5)20(25)17-18)27-23(29-24)31(4)19-11-15-30(3)16-12-19;1-5-7-15-31(14-6-2)23-28-21(26-17-8-9-20(32-4)19(24)16-17)27-22(29-23)30(3)18-10-12-25-13-11-18;1-4-6-10-24(9-5-2)17-22-15(19)21-16(23-17)20-12-7-8-14(25-3)13(18)11-12;1-18-7-3-2-5(4-6(7)11)14-10-16-8(12)15-9(13)17-10;1-8-7-3-5-9(2)6-4-7;1-3-5-7-8-6-4-2/h9-10,17,19H,6-8,11-16H2,1-5H3,(H,26,27,28,29);8-9,16,18,25H,5-7,10-15H2,1-4H3,(H,26,27,28,29);7-8,11H,4-6,9-10H2,1-3H3,(H,20,21,22,23);2-4H,1H3,(H,14,15,16,17);7-8H,3-6H2,1-2H3;8H,3-7H2,1-2H3.

What are the key properties of 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine?

2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine has a molecular weight of 1871.41 g/mol, XLogP of 19.92, 40 rotatable bonds, 7 hydrogen bond donors, and 30 hydrogen bond acceptors.

Where does this data come from?

All data for 2-N-butyl-6-chloro-4-N-(3-chloro-4-methoxyphenyl)-2-N-propyl-1,3,5-triazine-2,4-diamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-(1-methylpiperidin-4-yl)-2-N-propyl-1,3,5-triazine-2,4,6-triamine;2-N-butyl-6-N-(3-chloro-4-methoxyphenyl)-4-N-methyl-4-N-piperidin-4-yl-2-N-propyl-1,3,5-triazine-2,4,6-triamine;4,6-dichloro-N-(3-chloro-4-methoxyphenyl)-1,3,5-triazin-2-amine;N,1-dimethylpiperidin-4-amine;N-propylbutan-1-amine is sourced from PubChem (CID 159288325), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).