About 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide
6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide (PubChem CID 133260544) has the molecular formula C15H21N3O3
and a molecular weight of 291.35 g/mol. Its IUPAC name is 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide.
Molecular Properties
| Compound Name | 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide |
| PubChem CID | 133260544 |
| Molecular Formula | C15H21N3O3 |
| Molecular Weight | 291.35 g/mol |
| Exact Mass | 291.16 |
| IUPAC Name | 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide |
| SMILES | O=C(N[C@@H]1COC[C@H]1N1CCCCC1)c1ccc(=O)[nH]c1 |
| InChI | InChI=1S/C15H21N3O3/c19-14-5-4-11(8-16-14)15(20)17-12-9-21-10-13(12)18-6-2-1-3-7-18/h4-5,8,12-13H,1-3,6-7,9-10H2,(H,16,19)(H,17,20)/t12-,13-/m1/s1 |
| InChIKey | WQVHICIDXDUGLF-CHWSQXEVSA-N |
| XLogP | 0.36 |
| TPSA | 74.43 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Heavy Atoms | 21 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 291.35 |
| LogP ≤ 5 | 0.36 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 4 |
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Frequently Asked Questions
What is the IUPAC name of 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide?
The IUPAC name of 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide (CID 133260544) is 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide.
What is the SMILES notation for 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide?
The canonical SMILES for 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide is O=C(N[C@@H]1COC[C@H]1N1CCCCC1)c1ccc(=O)[nH]c1.
What is the InChIKey of 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide?
The InChIKey is WQVHICIDXDUGLF-CHWSQXEVSA-N. The full InChI is InChI=1S/C15H21N3O3/c19-14-5-4-11(8-16-14)15(20)17-12-9-21-10-13(12)18-6-2-1-3-7-18/h4-5,8,12-13H,1-3,6-7,9-10H2,(H,16,19)(H,17,20)/t12-,13-/m1/s1.
What are the key properties of 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide?
6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide has a molecular weight of 291.35 g/mol, XLogP of 0.36, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-oxo-N-[(3S,4S)-4-piperidin-1-yloxolan-3-yl]-1H-pyridine-3-carboxamide is sourced from PubChem (CID 133260544), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).