2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine

C69H80Cl10N36 — CID 165043433

About 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine

2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine (PubChem CID 165043433) has the molecular formula C69H80Cl10N36 and a molecular weight of 1768.18 g/mol. Its IUPAC name is 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

• Compound Name: 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
• PubChem CID: 165043433
• Molecular Formula: C69H80Cl10N36
• Molecular Weight: 1768.18 g/mol
• Exact Mass: 1762.43
• IUPAC Name: 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine
• SMILES: CC(C)Nc1nc(N)nc(NCCc2ccc(Cl)c(Cl)c2)n1.CN(C)c1nc(N)nc(NCCc2ccc(Cl)c(Cl)c2)n1.CN(C)c1nc(N)nc(NCc2ccc(Cl)c(Cl)c2)n1.CN(C)c1nc(N)nc(Nc2ccc(Cl)c(Cl)c2)n1.Nc1nc(N)nc(NCc2ccccc2Cl)n1.Nc1nc(N)nc(Nc2ccccc2Cl)n1
• InChI: InChI=1S/C14H18Cl2N6.C13H16Cl2N6.C12H14Cl2N6.C11H12Cl2N6.C10H11ClN6.C9H9ClN6/c1-8(2)19-14-21-12(17)20-13(22-14)18-6-5-9-3-4-10(15)11(16)7-9;1-21(2)13-19-11(16)18-12(20-13)17-6-5-8-3-4-9(14)10(15)7-8;1-20(2)12-18-10(15)17-11(19-12)16-6-7-3-4-8(13)9(14)5-7;1-19(2)11-17-9(14)16-10(18-11)15-6-3-4-7(12)8(13)5-6;11-7-4-2-1-3-6(7)5-14-10-16-8(12)15-9(13)17-10;10-5-3-1-2-4-6(5)13-9-15-7(11)14-8(12)16-9/h3-4,7-8H,5-6H2,1-2H3,(H4,17,18,19,20,21,22);3-4,7H,5-6H2,1-2H3,(H3,16,17,18,19,20);3-5H,6H2,1-2H3,(H3,15,16,17,18,19);3-5H,1-2H3,(H3,14,15,16,17,18);1-4H,5H2,(H5,12,13,14,15,16,17);1-4H,(H5,11,12,13,14,15,16)
• InChIKey: OMWSJSFQPNRJMT-UHFFFAOYSA-N
• XLogP: 13.46
• TPSA: 534.11 Ų
• H-Bond Donors: 15
• H-Bond Acceptors: 36
• Rotatable Bonds: 23
• Heavy Atoms: 115
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1768.18
LogP ≤ 5	13.46
H-Bond Donors ≤ 5	15
H-Bond Acceptors ≤ 10	36

Frequently Asked Questions

What is the IUPAC name of 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine?

The IUPAC name of 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine (CID 165043433) is 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine.

What is the SMILES notation for 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine?

The canonical SMILES for 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine is CC(C)Nc1nc(N)nc(NCCc2ccc(Cl)c(Cl)c2)n1.CN(C)c1nc(N)nc(NCCc2ccc(Cl)c(Cl)c2)n1.CN(C)c1nc(N)nc(NCc2ccc(Cl)c(Cl)c2)n1.CN(C)c1nc(N)nc(Nc2ccc(Cl)c(Cl)c2)n1.Nc1nc(N)nc(NCc2ccccc2Cl)n1.Nc1nc(N)nc(Nc2ccccc2Cl)n1.

What is the InChIKey of 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine?

The InChIKey is OMWSJSFQPNRJMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18Cl2N6.C13H16Cl2N6.C12H14Cl2N6.C11H12Cl2N6.C10H11ClN6.C9H9ClN6/c1-8(2)19-14-21-12(17)20-13(22-14)18-6-5-9-3-4-10(15)11(16)7-9;1-21(2)13-19-11(16)18-12(20-13)17-6-5-8-3-4-9(14)10(15)7-8;1-20(2)12-18-10(15)17-11(19-12)16-6-7-3-4-8(13)9(14)5-7;1-19(2)11-17-9(14)16-10(18-11)15-6-3-4-7(12)8(13)5-6;11-7-4-2-1-3-6(7)5-14-10-16-8(12)15-9(13)17-10;10-5-3-1-2-4-6(5)13-9-15-7(11)14-8(12)16-9/h3-4,7-8H,5-6H2,1-2H3,(H4,17,18,19,20,21,22);3-4,7H,5-6H2,1-2H3,(H3,16,17,18,19,20);3-5H,6H2,1-2H3,(H3,15,16,17,18,19);3-5H,1-2H3,(H3,14,15,16,17,18);1-4H,5H2,(H5,12,13,14,15,16,17);1-4H,(H5,11,12,13,14,15,16).

What are the key properties of 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine?

2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 1768.18 g/mol, XLogP of 13.46, 23 rotatable bonds, 15 hydrogen bond donors, and 36 hydrogen bond acceptors.

Where does this data come from?

All data for 2-N-[(2-chlorophenyl)methyl]-1,3,5-triazine-2,4,6-triamine;2-N-(2-chlorophenyl)-1,3,5-triazine-2,4,6-triamine;4-N-(3,4-dichlorophenyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine;4-N-[2-(3,4-dichlorophenyl)ethyl]-2-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine;4-N-[(3,4-dichlorophenyl)methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 165043433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).