Mol Weight - 201.066
Smiles - Cc1cc(Br)cnc1NC
| Property Name | Property Value |
| Mol Name | 5-Bromo-2-(N-Methylamino)-3-Methyl Pyridine |
| Molweight | 201.066 |
| Monoisotopic Mass | 199.994909 |
| Clogp | 1.7262 |
| Clogs | -2.584 |
| H Acceptors | 2 |
| H Donors | 1 |
| Total Surface Area | 126.63 |
| Relative Psa | 0.17713 |
| Polar Surface Area | 24.92 |
| Druglikeness | -2.2167 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.7 |
| Molecular Flexibility | 0.26123 |
| Molecular Complexity | 0.70527 |
| Fragments | 1 |
| Non H Atoms | 10 |
| Non Ch Atoms | 3 |
| Electronegative Atoms | 3 |
| Rotatable Bonds | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 2 |
| Aromatic Nitrogens | 1 |
| Basic Nitrogens | 1 |
| Smiles | Cc1cc(Br)cnc1NC |
| InChIKey | InChI=1S/C7H9BrN2/c1-5-3-6(8)4-10-7(5)9-2/h3-4H,1-2H3,(H,9,10) |
| InChI | QTBNIBCNVQMGPP-UHFFFAOYSA-N |
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1 — 5-Bromo-2-(N-Methylamino)-3-Methyl Pyridine | 2 — 5-Bromo-2-(N-Methylamino)-3-Methyl Pyridine