2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine

C121H133F15N16O8 — CID 167565196

About 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine

2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine (PubChem CID 167565196) has the molecular formula C121H133F15N16O8 and a molecular weight of 2224.47 g/mol. Its IUPAC name is 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine.

Molecular Properties

• Compound Name: 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine
• PubChem CID: 167565196
• Molecular Formula: C121H133F15N16O8
• Molecular Weight: 2224.47 g/mol
• Exact Mass: 2223.03
• IUPAC Name: 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine
• SMILES: Cc1ccc2c(c1)CC(c1nccn1C)N(CC(O)COc1ccc(C(F)(F)F)cc1)C2.Cc1ccccc1CN(CC(C)(C)COc1ccc(C(F)(F)F)cc1)C(=O)c1cncn1C.Cc1ccccc1CN(Cc1cccnc1)CC(C)(C)COc1cnc(C(F)(F)F)nc1.Cc1ccccc1CN(Cc1cccnc1)CC(C)COc1ccc(C(F)(F)F)cc1.Cn1cncc1C(=O)N(Cc1cccnc1)CC(C)(C)COc1ccc(C(F)(F)F)cc1
• InChI: InChI=1S/C25H28F3N3O2.C25H27F3N2O.C24H27F3N4O.C24H26F3N3O2.C23H25F3N4O2/c1-18-7-5-6-8-19(18)14-31(23(32)22-13-29-17-30(22)4)15-24(2,3)16-33-21-11-9-20(10-12-21)25(26,27)28;1-19(18-31-24-11-9-23(10-12-24)25(26,27)28)15-30(16-21-7-5-13-29-14-21)17-22-8-4-3-6-20(22)2;1-18-7-4-5-9-20(18)15-31(14-19-8-6-10-28-11-19)16-23(2,3)17-32-21-12-29-22(30-13-21)24(25,26)27;1-16-3-4-17-13-30(22(12-18(17)11-16)23-28-9-10-29(23)2)14-20(31)15-32-21-7-5-19(6-8-21)24(25,26)27;1-22(2,15-32-19-8-6-18(7-9-19)23(24,25)26)14-30(13-17-5-4-10-27-11-17)21(31)20-12-28-16-29(20)3/h5-13,17H,14-16H2,1-4H3;3-14,19H,15-18H2,1-2H3;4-13H,14-17H2,1-3H3;3-11,20,22,31H,12-15H2,1-2H3;4-12,16H,13-15H2,1-3H3
• InChIKey: FEODMLMPUSGZEM-UHFFFAOYSA-N
• XLogP: 25.80
• TPSA: 234.63 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 22
• Rotatable Bonds: 40
• Heavy Atoms: 160
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2224.47
LogP ≤ 5	25.80
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	22

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine?

The IUPAC name of 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine (CID 167565196) is 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine.

What is the SMILES notation for 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine?

The canonical SMILES for 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine is Cc1ccc2c(c1)CC(c1nccn1C)N(CC(O)COc1ccc(C(F)(F)F)cc1)C2.Cc1ccccc1CN(CC(C)(C)COc1ccc(C(F)(F)F)cc1)C(=O)c1cncn1C.Cc1ccccc1CN(Cc1cccnc1)CC(C)(C)COc1cnc(C(F)(F)F)nc1.Cc1ccccc1CN(Cc1cccnc1)CC(C)COc1ccc(C(F)(F)F)cc1.Cn1cncc1C(=O)N(Cc1cccnc1)CC(C)(C)COc1ccc(C(F)(F)F)cc1.

What is the InChIKey of 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine?

The InChIKey is FEODMLMPUSGZEM-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H28F3N3O2.C25H27F3N2O.C24H27F3N4O.C24H26F3N3O2.C23H25F3N4O2/c1-18-7-5-6-8-19(18)14-31(23(32)22-13-29-17-30(22)4)15-24(2,3)16-33-21-11-9-20(10-12-21)25(26,27)28;1-19(18-31-24-11-9-23(10-12-24)25(26,27)28)15-30(16-21-7-5-13-29-14-21)17-22-8-4-3-6-20(22)2;1-18-7-4-5-9-20(18)15-31(14-19-8-6-10-28-11-19)16-23(2,3)17-32-21-12-29-22(30-13-21)24(25,26)27;1-16-3-4-17-13-30(22(12-18(17)11-16)23-28-9-10-29(23)2)14-20(31)15-32-21-7-5-19(6-8-21)24(25,26)27;1-22(2,15-32-19-8-6-18(7-9-19)23(24,25)26)14-30(13-17-5-4-10-27-11-17)21(31)20-12-28-16-29(20)3/h5-13,17H,14-16H2,1-4H3;3-14,19H,15-18H2,1-2H3;4-13H,14-17H2,1-3H3;3-11,20,22,31H,12-15H2,1-2H3;4-12,16H,13-15H2,1-3H3.

What are the key properties of 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine?

2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine has a molecular weight of 2224.47 g/mol, XLogP of 25.80, 40 rotatable bonds, 1 hydrogen bond donors, and 22 hydrogen bond acceptors.

Where does this data come from?

All data for 2,2-dimethyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[2-(trifluoromethyl)pyrimidin-5-yl]oxypropan-1-amine;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-[(2-methylphenyl)methyl]imidazole-4-carboxamide;N-[2,2-dimethyl-3-[4-(trifluoromethyl)phenoxy]propyl]-3-methyl-N-(pyridin-3-ylmethyl)imidazole-4-carboxamide;1-[6-methyl-3-(1-methylimidazol-2-yl)-3,4-dihydro-1H-isoquinolin-2-yl]-3-[4-(trifluoromethyl)phenoxy]propan-2-ol;2-methyl-N-[(2-methylphenyl)methyl]-N-(pyridin-3-ylmethyl)-3-[4-(trifluoromethyl)phenoxy]propan-1-amine is sourced from PubChem (CID 167565196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).