Chemical Name - Piperidine
Mol Weight - 85.1493
Smiles - C1CCNCC1
Mol Weight - 85.1493
Smiles - C1CCNCC1
| Property Value | |
| Mol Name | Piperidine |
| Molweight | 85.1493 |
| Monoisotopic Mass | 85.089149 |
| Clogp | 0.7445 |
| Clogs | -1.125 |
| H Acceptors | 1 |
| H Donors | 1 |
| Total Surface Area | 80.26 |
| Relative Psa | 0.14279 |
| Polar Surface Area | 12.03 |
| Druglikeness | -2.8873 |
| Mutagenic | high |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 0.66667 |
| Molecular Flexibility | 0.23823 |
| Molecular Complexity | 0.53648 |
| Fragments | 1 |
| Non H Atoms | 6 |
| Non Ch Atoms | 1 |
| Electronegative Atoms | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3 Atoms | 6 |
| Symmetric Atoms | 2 |
| Amines | 1 |
| Alkyl Amines | 1 |
| Basic Nitrogens | 1 |
| Smiles | C1CCNCC1 |
| InChIKey | InChI=1S/C5H11N/c1-2-4-6-5-3-1/h6H,1-5H2 |
| InChI | NQRYJNQNLNOLGT-UHFFFAOYSA-N |
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