Chemical Name - Furfurylamine
Mol Weight - 97.1166
Smiles - NCc1ccco1
Mol Weight - 97.1166
Smiles - NCc1ccco1
| Property Value | |
| Mol Name | Furfurylamine |
| Molweight | 97.1166 |
| Monoisotopic Mass | 97.052764 |
| Clogp | -0.1468 |
| Clogs | -1.258 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 85.23 |
| Relative Psa | 0.34471 |
| Polar Surface Area | 39.16 |
| Druglikeness | -0.84751 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.71429 |
| Molecular Flexibility | 0.43512 |
| Molecular Complexity | 0.73241 |
| Fragments | 1 |
| Non H Atoms | 7 |
| Non Ch Atoms | 2 |
| Electronegative Atoms | 2 |
| Rotatable Bonds | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 5 |
| Sp3 Atoms | 2 |
| Amines | 1 |
| Alkyl Amines | 1 |
| Basic Nitrogens | 1 |
| Smiles | NCc1ccco1 |
| InChIKey | InChI=1S/C5H7NO/c6-4-5-2-1-3-7-5/h1-3H,4,6H2 |
| InChI | DDRPCXLAQZKBJP-UHFFFAOYSA-N |
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1 - Furfurylamine
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1 - Furfurylamine
2 - Furfurylamine
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