C170H259N29O7 — CID 158958501
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(5-(oxolan-3-yl)-2-propan-2-ylpyridine);1-(6-propan-2-yl-3-pyridinyl)azetidin-3-ol;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;2-propan-2-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridine;2-propan-2-yl-6-[(3R)-3-pyrrolidin-1-ylpyrrolidin-1-yl]pyridine;2-propan-2-yl-6-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]pyridine (PubChem CID 158958501) has the molecular formula C170H259N29O7 and a molecular weight of 2821.14 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(5-(oxolan-3-yl)-2-propan-2-ylpyridine);1-(6-propan-2-yl-3-pyridinyl)azetidin-3-ol;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;2-propan-2-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridine;2-propan-2-yl-6-[(3R)-3-pyrrolidin-1-ylpyrrolidin-1-yl]pyridine;2-propan-2-yl-6-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]pyridine.
| 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(5-(oxolan-3-yl)-2-propan-2-ylpyridine);1-(6-propan-2-yl-3-pyridinyl)azetidin-3-ol;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;2-propan-2-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridine;2-propan-2-yl-6-[(3R)-3-pyrrolidin-1-ylpyrrolidin-1-yl]pyridine;2-propan-2-yl-6-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]pyridine |
|---|---|
| PubChem CID | 158958501 |
| Molecular Formula | C170H259N29O7 |
| Molecular Weight | 2821.14 g/mol |
| Exact Mass | 2819.08 |
| 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(5-(oxolan-3-yl)-2-propan-2-ylpyridine);1-(6-propan-2-yl-3-pyridinyl)azetidin-3-ol;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;2-propan-2-yl-6-(3-pyrrolidin-1-ylpyrrolidin-1-yl)pyridine;2-propan-2-yl-6-[(3R)-3-pyrrolidin-1-ylpyrrolidin-1-yl]pyridine;2-propan-2-yl-6-[(3S)-3-pyrrolidin-1-ylpyrrolidin-1-yl]pyridine |
| SMILES | CC(C)c1ccc(C2CCOC2)cn1.CC(C)c1ccc(C2CCOC2)cn1.CC(C)c1ccc(C2CCOC2)cn1.CC(C)c1ccc(N2CC(O)C2)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.CC(C)c1cccc(N2CCC(N3CCCC3)C2)n1.CC(C)c1cccc(N2CC[C@@H](N3CCCC3)C2)n1.CC(C)c1cccc(N2CC[C@H](N3CCCC3)C2)n1.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/3C16H25N3.3C13H21N3.3C12H18N2O.3C12H17NO.C11H16N2O/c3*1-13(2)15-6-5-7-16(17-15)19-11-8-14(12-19)18-9-3-4-10-18;3*1-10(2)12-5-4-6-13(15-12)16-8-7-11(9-16)14-3;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;1-8(2)11-4-3-9(5-12-11)13-6-10(14)7-13/h3*5-7,13-14H,3-4,8-12H2,1-2H3;3*4-6,10-11,14H,7-9H2,1-3H3;3*3-4,7,9,11,15H,5-6,8H2,1-2H3;3*3-4,7,9,11H,5-6,8H2,1-2H3;3-5,8,10,14H,6-7H2,1-2H3/t2*14-;;2*11-;;2*11-;;;;;/m10.10.10...../s1 |
| InChIKey | JMHXABMSRONJOK-DTHLJKMRSA-N |
| XLogP | 29.49 |
| TPSA | 354.39 Ų |
| H-Bond Donors | 7 |
| H-Bond Acceptors | 36 |
| Rotatable Bonds | 32 |
| Heavy Atoms | 206 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 2821.14 |
| LogP ≤ 5 | 29.49 |
| H-Bond Donors ≤ 5 | 7 |
| H-Bond Acceptors ≤ 10 | 36 |