TL;DR: (1R,2S,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-amine (CAS 131348-11-3) is a chemical compound with molecular formula C10H19N and molecular weight 153.15175 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(1R,2S,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-amine
Also Known As: Bicyclo[2.2.1]heptan-2-amine, 1,3,3-trimethyl-, (1R,2S,4S)-, (1S,3S,4R)-2,2,4-trimethylbicyclo[2.2.1]heptan-3-amine
| Molecular Formula | C10H19N |
| Molecular Weight | 153.15175 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 26.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 153.15175 Da |
| Heavy Atoms | 11 |
| Complexity | 185.0 |
| SMILES | C[C@@]12CC[C@@H](C1)C([C@H]2N)(C)C |
| InChIKey | CBYXIIFIKSBHEY-QXFUBDJGSA-N |
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1R,2S,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-amine. With a topological polar surface area (TPSA) of 26.0 Ų, (1R,2S,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1R,2S,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-amine has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (1R,2S,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-amine is 131348-11-3.
The molecular formula of (1R,2S,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-amine is C10H19N.
The molecular weight of (1R,2S,4S)-1,3,3-trimethylbicyclo[2.2.1]heptan-2-amine is 153.15175 g/mol.
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