C65H95N19O10 — CID 159389911
N-(6-amino-3-pyridinyl)acetamide;N-(6-amino-3-pyridinyl)butanamide;N-[(6-amino-3-pyridinyl)methyl]-N-[[(2S)-oxolan-2-yl]methyl]acetamide;N-(6-amino-3-pyridinyl)-N-methylpropanamide;tert-butyl N-(6-amino-3-pyridinyl)carbamate;tert-butyl 4-[(6-amino-3-pyridinyl)-methylcarbamoyl]piperidine-1-carboxylate (PubChem CID 159389911) has the molecular formula C65H95N19O10 and a molecular weight of 1302.60 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)acetamide;N-(6-amino-3-pyridinyl)butanamide;N-[(6-amino-3-pyridinyl)methyl]-N-[[(2S)-oxolan-2-yl]methyl]acetamide;N-(6-amino-3-pyridinyl)-N-methylpropanamide;tert-butyl N-(6-amino-3-pyridinyl)carbamate;tert-butyl 4-[(6-amino-3-pyridinyl)-methylcarbamoyl]piperidine-1-carboxylate.
| Compound Name | N-(6-amino-3-pyridinyl)acetamide;N-(6-amino-3-pyridinyl)butanamide;N-[(6-amino-3-pyridinyl)methyl]-N-[[(2S)-oxolan-2-yl]methyl]acetamide;N-(6-amino-3-pyridinyl)-N-methylpropanamide;tert-butyl N-(6-amino-3-pyridinyl)carbamate;tert-butyl 4-[(6-amino-3-pyridinyl)-methylcarbamoyl]piperidine-1-carboxylate |
|---|---|
| PubChem CID | 159389911 |
| Molecular Formula | C65H95N19O10 |
| Molecular Weight | 1302.60 g/mol |
| Exact Mass | 1301.75 |
| IUPAC Name | N-(6-amino-3-pyridinyl)acetamide;N-(6-amino-3-pyridinyl)butanamide;N-[(6-amino-3-pyridinyl)methyl]-N-[[(2S)-oxolan-2-yl]methyl]acetamide;N-(6-amino-3-pyridinyl)-N-methylpropanamide;tert-butyl N-(6-amino-3-pyridinyl)carbamate;tert-butyl 4-[(6-amino-3-pyridinyl)-methylcarbamoyl]piperidine-1-carboxylate |
| SMILES | CC(=O)N(Cc1ccc(N)nc1)C[C@@H]1CCCO1.CC(=O)Nc1ccc(N)nc1.CC(C)(C)OC(=O)Nc1ccc(N)nc1.CCC(=O)N(C)c1ccc(N)nc1.CCCC(=O)Nc1ccc(N)nc1.CN(C(=O)C1CCN(C(=O)OC(C)(C)C)CC1)c1ccc(N)nc1 |
| InChI | InChI=1S/C17H26N4O3.C13H19N3O2.C10H15N3O2.2C9H13N3O.C7H9N3O/c1-17(2,3)24-16(23)21-9-7-12(8-10-21)15(22)20(4)13-5-6-14(18)19-11-13;1-10(17)16(9-12-3-2-6-18-12)8-11-4-5-13(14)15-7-11;1-10(2,3)15-9(14)13-7-4-5-8(11)12-6-7;1-3-9(13)12(2)7-4-5-8(10)11-6-7;1-2-3-9(13)12-7-4-5-8(10)11-6-7;1-5(11)10-6-2-3-7(8)9-4-6/h5-6,11-12H,7-10H2,1-4H3,(H2,18,19);4-5,7,12H,2-3,6,8-9H2,1H3,(H2,14,15);4-6H,1-3H3,(H2,11,12)(H,13,14);4-6H,3H2,1-2H3,(H2,10,11);4-6H,2-3H2,1H3,(H2,10,11)(H,12,13);2-4H,1H3,(H2,8,9)(H,10,11)/t;12-;;;;/m.0..../s1 |
| InChIKey | LLZBNADBAKWNGH-DYWLQACDSA-N |
| XLogP | 8.54 |
| TPSA | 429.69 Ų |
| H-Bond Donors | 9 |
| H-Bond Acceptors | 22 |
| Rotatable Bonds | 13 |
| Heavy Atoms | 94 |
| Complexity | — |
4 violations
| Rule | Value |
|---|---|
| MW ≤ 500 | 1302.60 |
| LogP ≤ 5 | 8.54 |
| H-Bond Donors ≤ 5 | 9 |
| H-Bond Acceptors ≤ 10 | 22 |