2-(4-methoxyphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyridine;11-(4-methoxypiperidin-1-yl)-8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-methyl-1-(8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-11-yl)hexan-3-one;2-(3-methylphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyrimidine;2-[3-(2-methylpropyl)phenyl]imidazo[1,2-a]pyrimidin-7-amine;2-[(1E,3E)-4-[6-(2-methylpropyl)-3-pyridinyl]buta-1,3-dienyl]-1,3-benzothiazol-6-ol;2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-7-amine;2-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrimidin-7-amine
C137H151N25O5S — CID 158478054
Data last refreshed: (MolForge compound catalog, from PubChem)
About 2-(4-methoxyphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyridine;11-(4-methoxypiperidin-1-yl)-8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-methyl-1-(8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-11-yl)hexan-3-one;2-(3-methylphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyrimidine;2-[3-(2-methylpropyl)phenyl]imidazo[1,2-a]pyrimidin-7-amine;2-[(1E,3E)-4-[6-(2-methylpropyl)-3-pyridinyl]buta-1,3-dienyl]-1,3-benzothiazol-6-ol;2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-7-amine;2-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrimidin-7-amine
2-(4-methoxyphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyridine;11-(4-methoxypiperidin-1-yl)-8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-methyl-1-(8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-11-yl)hexan-3-one;2-(3-methylphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyrimidine;2-[3-(2-methylpropyl)phenyl]imidazo[1,2-a]pyrimidin-7-amine;2-[(1E,3E)-4-[6-(2-methylpropyl)-3-pyridinyl]buta-1,3-dienyl]-1,3-benzothiazol-6-ol;2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-7-amine;2-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrimidin-7-amine (PubChem CID 158478054) has the molecular formula C137H151N25O5S and a molecular weight of 2259.95 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyridine;11-(4-methoxypiperidin-1-yl)-8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-methyl-1-(8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-11-yl)hexan-3-one;2-(3-methylphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyrimidine;2-[3-(2-methylpropyl)phenyl]imidazo[1,2-a]pyrimidin-7-amine;2-[(1E,3E)-4-[6-(2-methylpropyl)-3-pyridinyl]buta-1,3-dienyl]-1,3-benzothiazol-6-ol;2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-7-amine;2-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrimidin-7-amine.
Molecular Properties
| Compound Name | 2-(4-methoxyphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyridine;11-(4-methoxypiperidin-1-yl)-8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-methyl-1-(8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-11-yl)hexan-3-one;2-(3-methylphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyrimidine;2-[3-(2-methylpropyl)phenyl]imidazo[1,2-a]pyrimidin-7-amine;2-[(1E,3E)-4-[6-(2-methylpropyl)-3-pyridinyl]buta-1,3-dienyl]-1,3-benzothiazol-6-ol;2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-7-amine;2-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrimidin-7-amine |
|---|---|
| PubChem CID | 158478054 |
| Molecular Formula | C137H151N25O5S |
| Molecular Weight | 2259.95 g/mol |
| Exact Mass | 2258.21 |
| IUPAC Name | 2-(4-methoxyphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyridine;11-(4-methoxypiperidin-1-yl)-8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaene;5-methyl-1-(8-methyl-4,8,10-triazatricyclo[7.4.0.02,7]trideca-1(9),2(7),3,5,10,12-hexaen-11-yl)hexan-3-one;2-(3-methylphenyl)-7-(2-methylpropyl)imidazo[1,2-a]pyrimidine;2-[3-(2-methylpropyl)phenyl]imidazo[1,2-a]pyrimidin-7-amine;2-[(1E,3E)-4-[6-(2-methylpropyl)-3-pyridinyl]buta-1,3-dienyl]-1,3-benzothiazol-6-ol;2-(4-propan-2-yloxyphenyl)imidazo[1,2-a]pyridin-7-amine;2-(3-propan-2-ylphenyl)imidazo[1,2-a]pyrimidin-7-amine |
| SMILES | CC(C)CC(=O)CCc1ccc2c3cnccc3n(C)c2n1.CC(C)Cc1ccc(/C=C/C=C/c2nc3ccc(O)cc3s2)cn1.CC(C)Cc1cccc(-c2cn3ccc(N)nc3n2)c1.CC(C)Oc1ccc(-c2cn3ccc(N)cc3n2)cc1.CC(C)c1cccc(-c2cn3ccc(N)nc3n2)c1.COC1CCN(c2ccc3c4cnccc4n(C)c3n2)CC1.COc1ccc(-c2cn3ccc(CC(C)C)cc3n2)cc1.Cc1cccc(-c2cn3ccc(CC(C)C)nc3n2)c1 |
| InChI | InChI=1S/C20H20N2OS.C18H21N3O.C18H20N2O.C17H20N4O.C17H19N3.C16H18N4.C16H17N3O.C15H16N4/c1-14(2)11-16-8-7-15(13-21-16)5-3-4-6-20-22-18-10-9-17(23)12-19(18)24-20;1-12(2)10-14(22)6-4-13-5-7-15-16-11-19-9-8-17(16)21(3)18(15)20-13;1-13(2)10-14-8-9-20-12-17(19-18(20)11-14)15-4-6-16(21-3)7-5-15;1-20-15-5-8-18-11-14(15)13-3-4-16(19-17(13)20)21-9-6-12(22-2)7-10-21;1-12(2)9-15-7-8-20-11-16(19-17(20)18-15)14-6-4-5-13(3)10-14;1-11(2)8-12-4-3-5-13(9-12)14-10-20-7-6-15(17)19-16(20)18-14;1-11(2)20-14-5-3-12(4-6-14)15-10-19-8-7-13(17)9-16(19)18-15;1-10(2)11-4-3-5-12(8-11)13-9-19-7-6-14(16)18-15(19)17-13/h3-10,12-14,23H,11H2,1-2H3;5,7-9,11-12H,4,6,10H2,1-3H3;4-9,11-13H,10H2,1-3H3;3-5,8,11-12H,6-7,9-10H2,1-2H3;4-8,10-12H,9H2,1-3H3;3-7,9-11H,8H2,1-2H3,(H2,17,18,19);3-11H,17H2,1-2H3;3-10H,1-2H3,(H2,16,17,18)/b5-3+,6-4+;;;;;;; |
| InChIKey | HHEIUFQTUQRKJZ-LIAOTRHCSA-N |
| XLogP | 29.49 |
| TPSA | 358.66 Ų |
| H-Bond Donors | 4 |
| H-Bond Acceptors | 31 |
| Rotatable Bonds | 27 |
| Heavy Atoms | 168 |
| Complexity | — |
Lipinski Rule of Five
3 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2259.95 |
| LogP ≤ 5 | 29.49 |
| H-Bond Donors ≤ 5 | 4 |
| H-Bond Acceptors ≤ 10 | 31 |
Computed Properties (RDKit)
| Structural Alerts | {'alert_name': 'polyene', 'substructure': 'N/A'} |
|---|
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Sources
- PubChem CID 158478054 — identifiers, structure, computed properties (public domain)
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