Chemical Name - Pyrrolidine
Mol Weight - 71.1225
Smiles - C1CNCC1
Mol Weight - 71.1225
Smiles - C1CNCC1
| Property Value | |
| Mol Name | Pyrrolidine |
| Molweight | 71.1225 |
| Monoisotopic Mass | 71.073499 |
| Clogp | 0.4025 |
| Clogs | -0.855 |
| H Acceptors | 1 |
| H Donors | 1 |
| Total Surface Area | 66.5 |
| Relative Psa | 0.17233 |
| Polar Surface Area | 12.03 |
| Druglikeness | -0.72478 |
| Mutagenic | high |
| Tumorigenic | high |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 0.6 |
| Molecular Complexity | 0.80472 |
| Fragments | 1 |
| Non H Atoms | 5 |
| Non Ch Atoms | 1 |
| Electronegative Atoms | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3 Atoms | 5 |
| Symmetric Atoms | 2 |
| Amines | 1 |
| Alkyl Amines | 1 |
| Basic Nitrogens | 1 |
| Smiles | C1CNCC1 |
| InChIKey | InChI=1S/C4H9N/c1-2-4-5-3-1/h5H,1-4H2 |
| InChI | RWRDLPDLKQPQOW-UHFFFAOYSA-N |
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1 - Pyrrolidine
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