About N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide
N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide (PubChem CID 63638833) has the molecular formula C11H18N4OS
and a molecular weight of 254.36 g/mol. Its IUPAC name is N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide.
Molecular Properties
| Compound Name | N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide |
| PubChem CID | 63638833 |
| Molecular Formula | C11H18N4OS |
| Molecular Weight | 254.36 g/mol |
| Exact Mass | 254.12 |
| IUPAC Name | N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide |
| SMILES | CCCN(C(=O)c1cnns1)C1CCCNC1 |
| InChI | InChI=1S/C11H18N4OS/c1-2-6-15(9-4-3-5-12-7-9)11(16)10-8-13-14-17-10/h8-9,12H,2-7H2,1H3 |
| InChIKey | SBTBMPYASIUTNS-UHFFFAOYSA-N |
| XLogP | 1.14 |
| TPSA | 58.12 Ų |
| H-Bond Donors | 1 |
| H-Bond Acceptors | 5 |
| Rotatable Bonds | 4 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 254.36 |
| LogP ≤ 5 | 1.14 |
| H-Bond Donors ≤ 5 | 1 |
| H-Bond Acceptors ≤ 10 | 5 |
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Frequently Asked Questions
What is the IUPAC name of N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide?
The IUPAC name of N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide (CID 63638833) is N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide.
What is the SMILES notation for N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide?
The canonical SMILES for N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide is CCCN(C(=O)c1cnns1)C1CCCNC1.
What is the InChIKey of N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide?
The InChIKey is SBTBMPYASIUTNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4OS/c1-2-6-15(9-4-3-5-12-7-9)11(16)10-8-13-14-17-10/h8-9,12H,2-7H2,1H3.
What are the key properties of N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide?
N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide has a molecular weight of 254.36 g/mol, XLogP of 1.14, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-piperidin-3-yl-N-propylthiadiazole-5-carboxamide is sourced from PubChem (CID 63638833), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).