Mol Weight - 149.236
Smiles - CC(CCc1ccccc1)N
| Property Name | Property Value |
| Mol Name | 1-Methyl-3-Phenylpropylamine |
| Molweight | 149.236 |
| Monoisotopic Mass | 149.120449 |
| Clogp | 1.9083 |
| Clogs | -2.336 |
| H Acceptors | 1 |
| H Donors | 1 |
| Total Surface Area | 134.06 |
| Relative Psa | 0.1139 |
| Polar Surface Area | 26.02 |
| Druglikeness | -2.5905 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | high |
| Irritant | high |
| Shape Index | 0.72727 |
| Molecular Flexibility | 0.5491 |
| Molecular Complexity | 0.52781 |
| Fragments | 1 |
| Non H Atoms | 11 |
| Non Ch Atoms | 1 |
| Electronegative Atoms | 1 |
| Stereo Centers | 1 |
| Rotatable Bonds | 3 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Aromatic Rings | 1 |
| Aromatic Atoms | 6 |
| Sp3 Atoms | 5 |
| Symmetric Atoms | 2 |
| Amines | 1 |
| Alkyl Amines | 1 |
| Basic Nitrogens | 1 |
| Smiles | CC(CCc1ccccc1)N |
| InChIKey | InChI=1S/C10H15N/c1-9(11)7-8-10-5-3-2-4-6-10/h2-6,9H,7-8,11H2,1H3 |
| InChI | WECUIGDEWBNQJJ-UHFFFAOYSA-N |
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1 — 1-Methyl-3-Phenylpropylamine | 2 — 1-Methyl-3-Phenylpropylamine