About 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol
1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol (PubChem CID 83991148) has the molecular formula C14H28N2O
and a molecular weight of 240.39 g/mol. Its IUPAC name is 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol.
Molecular Properties
| Compound Name | 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol |
| PubChem CID | 83991148 |
| Molecular Formula | C14H28N2O |
| Molecular Weight | 240.39 g/mol |
| Exact Mass | 240.22 |
| IUPAC Name | 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol |
| SMILES | CCCNC1CC(C(O)CC)CN(C2CC2)C1 |
| InChI | InChI=1S/C14H28N2O/c1-3-7-15-12-8-11(14(17)4-2)9-16(10-12)13-5-6-13/h11-15,17H,3-10H2,1-2H3 |
| InChIKey | HWMUMDXXHSREAZ-UHFFFAOYSA-N |
| XLogP | 1.61 |
| TPSA | 35.50 Ų |
| H-Bond Donors | 2 |
| H-Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Heavy Atoms | 17 |
| Complexity | — |
Lipinski Rule of Five
Passes Rule of Five
| Rule | Value |
| MW ≤ 500 | 240.39 |
| LogP ≤ 5 | 1.61 |
| H-Bond Donors ≤ 5 | 2 |
| H-Bond Acceptors ≤ 10 | 3 |
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Frequently Asked Questions
What is the IUPAC name of 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol?
The IUPAC name of 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol (CID 83991148) is 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol.
What is the SMILES notation for 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol?
The canonical SMILES for 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol is CCCNC1CC(C(O)CC)CN(C2CC2)C1.
What is the InChIKey of 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol?
The InChIKey is HWMUMDXXHSREAZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-3-7-15-12-8-11(14(17)4-2)9-16(10-12)13-5-6-13/h11-15,17H,3-10H2,1-2H3.
What are the key properties of 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol?
1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol has a molecular weight of 240.39 g/mol, XLogP of 1.61, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-cyclopropyl-5-(propylamino)piperidin-3-yl]propan-1-ol is sourced from PubChem (CID 83991148), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).