6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine

C130H158Cl4N32O — CID 159378439

About 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine

6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine (PubChem CID 159378439) has the molecular formula C130H158Cl4N32O and a molecular weight of 2326.73 g/mol. Its IUPAC name is 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine.

Molecular Properties

• Compound Name: 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine
• PubChem CID: 159378439
• Molecular Formula: C130H158Cl4N32O
• Molecular Weight: 2326.73 g/mol
• Exact Mass: 2323.21
• IUPAC Name: 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine
• SMILES: COCCN(c1nc(Nc2ccc(C)cc2)cc(N(C)C)n1)C1CCCCC1.C[C@H]1CC2CC([C@@H]1Nc1cc(N(C)C)nc(Nc3ccccc3)n1)C2(C)C.Cc1cc(Nc2cc(N(C)C)nc(N(C)CCc3c[nH]c4ccccc34)n2)ccc1Cl.Cc1ccc(Nc2cc(N(C)C)nc(N(C)CCc3c[nH]c4ccccc34)n2)cc1.Cc1ccc(Nc2cc(N(C)C)nc(Nc3ccc(Cl)c(Cl)c3)n2)cc1.Cc1ccc(Nc2cc(N(C)C)nc(Nc3ccccc3)n2)cc1Cl
• InChI: InChI=1S/C24H27ClN6.C24H28N6.C22H33N5O.C22H31N5.C19H19Cl2N5.C19H20ClN5/c1-16-13-18(9-10-20(16)25)27-22-14-23(30(2)3)29-24(28-22)31(4)12-11-17-15-26-21-8-6-5-7-19(17)21;1-17-9-11-19(12-10-17)26-22-15-23(29(2)3)28-24(27-22)30(4)14-13-18-16-25-21-8-6-5-7-20(18)21;1-17-10-12-18(13-11-17)23-20-16-21(26(2)3)25-22(24-20)27(14-15-28-4)19-8-6-5-7-9-19;1-14-11-15-12-17(22(15,2)3)20(14)24-18-13-19(27(4)5)26-21(25-18)23-16-9-7-6-8-10-16;1-12-4-6-13(7-5-12)22-17-11-18(26(2)3)25-19(24-17)23-14-8-9-15(20)16(21)10-14;1-13-9-10-15(11-16(13)20)21-17-12-18(25(2)3)24-19(23-17)22-14-7-5-4-6-8-14/h5-10,13-15,26H,11-12H2,1-4H3,(H,27,28,29);5-12,15-16,25H,13-14H2,1-4H3,(H,26,27,28);10-13,16,19H,5-9,14-15H2,1-4H3,(H,23,24,25);6-10,13-15,17,20H,11-12H2,1-5H3,(H2,23,24,25,26);4-11H,1-3H3,(H2,22,23,24,25);4-12H,1-3H3,(H2,21,22,23,24)/t;;;14-,15?,17?,20+;;/m...0../s1
• InChIKey: LKPLVGSDPNUCPN-NGNZQVJUSA-N
• XLogP: 29.95
• TPSA: 332.92 Ų
• H-Bond Donors: 11
• H-Bond Acceptors: 31
• Rotatable Bonds: 37
• Heavy Atoms: 167
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2326.73
LogP ≤ 5	29.95
H-Bond Donors ≤ 5	11
H-Bond Acceptors ≤ 10	31

Frequently Asked Questions

What is the IUPAC name of 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine?

The IUPAC name of 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine (CID 159378439) is 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine.

What is the SMILES notation for 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine?

The canonical SMILES for 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine is COCCN(c1nc(Nc2ccc(C)cc2)cc(N(C)C)n1)C1CCCCC1.C[C@H]1CC2CC([C@@H]1Nc1cc(N(C)C)nc(Nc3ccccc3)n1)C2(C)C.Cc1cc(Nc2cc(N(C)C)nc(N(C)CCc3c[nH]c4ccccc34)n2)ccc1Cl.Cc1ccc(Nc2cc(N(C)C)nc(N(C)CCc3c[nH]c4ccccc34)n2)cc1.Cc1ccc(Nc2cc(N(C)C)nc(Nc3ccc(Cl)c(Cl)c3)n2)cc1.Cc1ccc(Nc2cc(N(C)C)nc(Nc3ccccc3)n2)cc1Cl.

What is the InChIKey of 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine?

The InChIKey is LKPLVGSDPNUCPN-NGNZQVJUSA-N. The full InChI is InChI=1S/C24H27ClN6.C24H28N6.C22H33N5O.C22H31N5.C19H19Cl2N5.C19H20ClN5/c1-16-13-18(9-10-20(16)25)27-22-14-23(30(2)3)29-24(28-22)31(4)12-11-17-15-26-21-8-6-5-7-19(17)21;1-17-9-11-19(12-10-17)26-22-15-23(29(2)3)28-24(27-22)30(4)14-13-18-16-25-21-8-6-5-7-20(18)21;1-17-10-12-18(13-11-17)23-20-16-21(26(2)3)25-22(24-20)27(14-15-28-4)19-8-6-5-7-9-19;1-14-11-15-12-17(22(15,2)3)20(14)24-18-13-19(27(4)5)26-21(25-18)23-16-9-7-6-8-10-16;1-12-4-6-13(7-5-12)22-17-11-18(26(2)3)25-19(24-17)23-14-8-9-15(20)16(21)10-14;1-13-9-10-15(11-16(13)20)21-17-12-18(25(2)3)24-19(23-17)22-14-7-5-4-6-8-14/h5-10,13-15,26H,11-12H2,1-4H3,(H,27,28,29);5-12,15-16,25H,13-14H2,1-4H3,(H,26,27,28);10-13,16,19H,5-9,14-15H2,1-4H3,(H,23,24,25);6-10,13-15,17,20H,11-12H2,1-5H3,(H2,23,24,25,26);4-11H,1-3H3,(H2,22,23,24,25);4-12H,1-3H3,(H2,21,22,23,24)/t;;;14-,15?,17?,20+;;/m...0../s1.

What are the key properties of 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine?

6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine has a molecular weight of 2326.73 g/mol, XLogP of 29.95, 37 rotatable bonds, 11 hydrogen bond donors, and 31 hydrogen bond acceptors.

Where does this data come from?

All data for 6-N-(3-chloro-4-methylphenyl)-4-N,4-N-dimethyl-2-N-phenylpyrimidine-2,4,6-triamine;6-N-(4-chloro-3-methylphenyl)-2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethylpyrimidine-2,4,6-triamine;2-N-cyclohexyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;2-N-(3,4-dichlorophenyl)-4-N,4-N-dimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine;4-N,4-N-dimethyl-2-N-phenyl-6-N-[(2R,3S)-3,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl]pyrimidine-2,4,6-triamine;2-N-[2-(1H-indol-3-yl)ethyl]-2-N,4-N,4-N-trimethyl-6-N-(4-methylphenyl)pyrimidine-2,4,6-triamine is sourced from PubChem (CID 159378439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).