C150H222N24O9 — CID 159458397
N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;(3R)-N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;(3S)-N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;tris(1-methyl-4-(6-propan-2-yl-3-pyridinyl)pyrrolidin-2-one);tris(5-(oxolan-3-yl)-2-propan-2-ylpyridine);1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol;(3R)-1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol;(3S)-1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol (PubChem CID 159458397) has the molecular formula C150H222N24O9 and a molecular weight of 2505.58 g/mol. Its IUPAC name is N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;(3R)-N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;(3S)-N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;tris(1-methyl-4-(6-propan-2-yl-3-pyridinyl)pyrrolidin-2-one);tris(5-(oxolan-3-yl)-2-propan-2-ylpyridine);1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol;(3R)-1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol;(3S)-1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol.
| Compound Name | N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;(3R)-N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;(3S)-N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;tris(1-methyl-4-(6-propan-2-yl-3-pyridinyl)pyrrolidin-2-one);tris(5-(oxolan-3-yl)-2-propan-2-ylpyridine);1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol;(3R)-1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol;(3S)-1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol |
|---|---|
| PubChem CID | 159458397 |
| Molecular Formula | C150H222N24O9 |
| Molecular Weight | 2505.58 g/mol |
| Exact Mass | 2503.77 |
| IUPAC Name | N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;(3R)-N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;(3S)-N-methyl-1-(6-propan-2-yl-2-pyridinyl)pyrrolidin-3-amine;tris(1-methyl-4-(6-propan-2-yl-3-pyridinyl)pyrrolidin-2-one);tris(5-(oxolan-3-yl)-2-propan-2-ylpyridine);1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol;(3R)-1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol;(3S)-1-(6-propan-2-yl-3-pyridinyl)pyrrolidin-3-ol |
| SMILES | CC(C)c1ccc(C2CC(=O)N(C)C2)cn1.CC(C)c1ccc(C2CC(=O)N(C)C2)cn1.CC(C)c1ccc(C2CC(=O)N(C)C2)cn1.CC(C)c1ccc(C2CCOC2)cn1.CC(C)c1ccc(C2CCOC2)cn1.CC(C)c1ccc(C2CCOC2)cn1.CC(C)c1ccc(N2CCC(O)C2)cn1.CC(C)c1ccc(N2CC[C@@H](O)C2)cn1.CC(C)c1ccc(N2CC[C@H](O)C2)cn1.CNC1CCN(c2cccc(C(C)C)n2)C1.CN[C@@H]1CCN(c2cccc(C(C)C)n2)C1.CN[C@H]1CCN(c2cccc(C(C)C)n2)C1 |
| InChI | InChI=1S/3C13H21N3.3C13H18N2O.3C12H18N2O.3C12H17NO/c3*1-10(2)12-5-4-6-13(15-12)16-8-7-11(9-16)14-3;3*1-9(2)12-5-4-10(7-14-12)11-6-13(16)15(3)8-11;3*1-9(2)12-4-3-10(7-13-12)14-6-5-11(15)8-14;3*1-9(2)12-4-3-10(7-13-12)11-5-6-14-8-11/h3*4-6,10-11,14H,7-9H2,1-3H3;3*4-5,7,9,11H,6,8H2,1-3H3;3*3-4,7,9,11,15H,5-6,8H2,1-2H3;3*3-4,7,9,11H,5-6,8H2,1-2H3/t2*11-;;;;;2*11-;;;;/m10....10..../s1 |
| InChIKey | LUGUNUMBTOMCQA-QWUMRSSBSA-N |
| XLogP | 25.92 |
| TPSA | 359.52 Ų |
| H-Bond Donors | 6 |
| H-Bond Acceptors | 30 |
| Rotatable Bonds | 27 |
| Heavy Atoms | 183 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2505.58 |
| LogP ≤ 5 | 25.92 |
| H-Bond Donors ≤ 5 | 6 |
| H-Bond Acceptors ≤ 10 | 30 |