Mol Weight - 113.203
Smiles - C[C@H](CC1)CC[C@@H]1N
| Property Name | Property Value |
| Mol Name | Trans 4-Methyl Cyclohexyl Amine |
| Molweight | 113.203 |
| Monoisotopic Mass | 113.120449 |
| Clogp | 1.0714 |
| Clogs | -1.987 |
| H Acceptors | 1 |
| H Donors | 1 |
| Total Surface Area | 100.82 |
| Relative Psa | 0.15146 |
| Polar Surface Area | 26.02 |
| Druglikeness | -3.5155 |
| Mutagenic | none |
| Tumorigenic | none |
| Reproductive Effective | none |
| Irritant | none |
| Shape Index | 0.75 |
| Molecular Flexibility | 0.13919 |
| Molecular Complexity | 0.59947 |
| Fragments | 1 |
| Non H Atoms | 8 |
| Non Ch Atoms | 1 |
| Electronegative Atoms | 1 |
| Rings Closures | 1 |
| Small Rings | 1 |
| Sp3 Atoms | 8 |
| Symmetric Atoms | 2 |
| Amines | 1 |
| Alkyl Amines | 1 |
| Basic Nitrogens | 1 |
| Smiles | C[C@H](CC1)CC[C@@H]1N |
| InChIKey | InChI=1S/C7H15N/c1-6-2-4-7(8)5-3-6/h6-7H,2-5,8H2,1H3 |
| InChI | KSMVBYPXNKCPAJ-UHFFFAOYSA-N |
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1 — Trans 4-Methyl Cyclohexyl Amine | 2 — Trans 4-Methyl Cyclohexyl Amine