2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide

C142H164F3N45O12 — CID 159428233

About 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide

2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide (PubChem CID 159428233) has the molecular formula C142H164F3N45O12 and a molecular weight of 2750.17 g/mol. Its IUPAC name is 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide.

Molecular Properties

• Compound Name: 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide
• PubChem CID: 159428233
• Molecular Formula: C142H164F3N45O12
• Molecular Weight: 2750.17 g/mol
• Exact Mass: 2748.36
• IUPAC Name: 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide
• SMILES: CCc1nc(NCCN(CC)CC)nc(Nc2ncc(C(=O)Nc3c(C)cccc3C)o2)n1.CCc1nc(Nc2ccccc2)nc(Nc2ncc(C(=O)Nc3c(C)cccc3C)o2)n1.CCc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3C)o2)nc(N(C)C)n1.CCc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3C)o2)nc(N2CCCCC2)n1.Cc1cc(C)c(NC(=O)c2cnc(Nc3nc(C)nc(N4CCN(c5cccc(C(F)(F)F)c5)CC4)n3)o2)c(C)c1.Cc1cc(C)c(NC(=O)c2cnc(Nc3nc(C)nc(N4CCN(c5ccccc5)CC4)n3)o2)c(C)c1
• InChI: InChI=1S/C28H29F3N8O2.C27H30N8O2.C23H32N8O2.C23H23N7O2.C22H27N7O2.C19H23N7O2/c1-16-12-17(2)23(18(3)13-16)35-24(40)22-15-32-27(41-22)37-25-33-19(4)34-26(36-25)39-10-8-38(9-11-39)21-7-5-6-20(14-21)28(29,30)31;1-17-14-18(2)23(19(3)15-17)31-24(36)22-16-28-27(37-22)33-25-29-20(4)30-26(32-25)35-12-10-34(11-13-35)21-8-6-5-7-9-21;1-6-18-26-21(24-12-13-31(7-2)8-3)29-22(27-18)30-23-25-14-17(33-23)20(32)28-19-15(4)10-9-11-16(19)5;1-4-18-26-21(25-16-11-6-5-7-12-16)29-22(27-18)30-23-24-13-17(32-23)20(31)28-19-14(2)9-8-10-15(19)3;1-4-17-24-20(27-21(25-17)29-11-6-5-7-12-29)28-22-23-13-16(31-22)19(30)26-18-14(2)9-8-10-15(18)3;1-6-14-21-17(24-18(22-14)26(4)5)25-19-20-10-13(28-19)16(27)23-15-11(2)8-7-9-12(15)3/h5-7,12-15H,8-11H2,1-4H3,(H,35,40)(H,32,33,34,36,37);5-9,14-16H,10-13H2,1-4H3,(H,31,36)(H,28,29,30,32,33);9-11,14H,6-8,12-13H2,1-5H3,(H,28,32)(H2,24,25,26,27,29,30);5-13H,4H2,1-3H3,(H,28,31)(H2,24,25,26,27,29,30);8-10,13H,4-7,11-12H2,1-3H3,(H,26,30)(H,23,24,25,27,28);7-10H,6H2,1-5H3,(H,23,27)(H,20,21,22,24,25)
• InChIKey: LQQMQRPDKQANIU-UHFFFAOYSA-N
• XLogP: 25.54
• TPSA: 681.72 Ų
• H-Bond Donors: 14
• H-Bond Acceptors: 51
• Rotatable Bonds: 42
• Heavy Atoms: 202
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	2750.17
LogP ≤ 5	25.54
H-Bond Donors ≤ 5	14
H-Bond Acceptors ≤ 10	51

Frequently Asked Questions

What is the IUPAC name of 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide?

The IUPAC name of 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide (CID 159428233) is 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide.

What is the SMILES notation for 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide?

The canonical SMILES for 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide is CCc1nc(NCCN(CC)CC)nc(Nc2ncc(C(=O)Nc3c(C)cccc3C)o2)n1.CCc1nc(Nc2ccccc2)nc(Nc2ncc(C(=O)Nc3c(C)cccc3C)o2)n1.CCc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3C)o2)nc(N(C)C)n1.CCc1nc(Nc2ncc(C(=O)Nc3c(C)cccc3C)o2)nc(N2CCCCC2)n1.Cc1cc(C)c(NC(=O)c2cnc(Nc3nc(C)nc(N4CCN(c5cccc(C(F)(F)F)c5)CC4)n3)o2)c(C)c1.Cc1cc(C)c(NC(=O)c2cnc(Nc3nc(C)nc(N4CCN(c5ccccc5)CC4)n3)o2)c(C)c1.

What is the InChIKey of 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide?

The InChIKey is LQQMQRPDKQANIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C28H29F3N8O2.C27H30N8O2.C23H32N8O2.C23H23N7O2.C22H27N7O2.C19H23N7O2/c1-16-12-17(2)23(18(3)13-16)35-24(40)22-15-32-27(41-22)37-25-33-19(4)34-26(36-25)39-10-8-38(9-11-39)21-7-5-6-20(14-21)28(29,30)31;1-17-14-18(2)23(19(3)15-17)31-24(36)22-16-28-27(37-22)33-25-29-20(4)30-26(32-25)35-12-10-34(11-13-35)21-8-6-5-7-9-21;1-6-18-26-21(24-12-13-31(7-2)8-3)29-22(27-18)30-23-25-14-17(33-23)20(32)28-19-15(4)10-9-11-16(19)5;1-4-18-26-21(25-16-11-6-5-7-12-16)29-22(27-18)30-23-24-13-17(32-23)20(31)28-19-14(2)9-8-10-15(19)3;1-4-17-24-20(27-21(25-17)29-11-6-5-7-12-29)28-22-23-13-16(31-22)19(30)26-18-14(2)9-8-10-15(18)3;1-6-14-21-17(24-18(22-14)26(4)5)25-19-20-10-13(28-19)16(27)23-15-11(2)8-7-9-12(15)3/h5-7,12-15H,8-11H2,1-4H3,(H,35,40)(H,32,33,34,36,37);5-9,14-16H,10-13H2,1-4H3,(H,31,36)(H,28,29,30,32,33);9-11,14H,6-8,12-13H2,1-5H3,(H,28,32)(H2,24,25,26,27,29,30);5-13H,4H2,1-3H3,(H,28,31)(H2,24,25,26,27,29,30);8-10,13H,4-7,11-12H2,1-3H3,(H,26,30)(H,23,24,25,27,28);7-10H,6H2,1-5H3,(H,23,27)(H,20,21,22,24,25).

What are the key properties of 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide?

2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide has a molecular weight of 2750.17 g/mol, XLogP of 25.54, 42 rotatable bonds, 14 hydrogen bond donors, and 51 hydrogen bond acceptors.

Where does this data come from?

All data for 2-[(4-anilino-6-ethyl-1,3,5-triazin-2-yl)amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-[2-(diethylamino)ethylamino]-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-(dimethylamino)-6-ethyl-1,3,5-triazin-2-yl]amino]-N-(2,6-dimethylphenyl)-1,3-oxazole-5-carboxamide;N-(2,6-dimethylphenyl)-2-[(4-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-yl)amino]-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-(4-phenylpiperazin-1-yl)-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide;2-[[4-methyl-6-[4-[3-(trifluoromethyl)phenyl]piperazin-1-yl]-1,3,5-triazin-2-yl]amino]-N-(2,4,6-trimethylphenyl)-1,3-oxazole-5-carboxamide is sourced from PubChem (CID 159428233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).