TL;DR: 2-Cyclohexyl-2-(methylamino)acetic acid (CAS 1218286-14-6) is a chemical compound with molecular formula C9H17NO2 and molecular weight 171.12593 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-cyclohexyl-2-(methylamino)acetic acid
Also Known As: a-(Methylamino)cyclohexaneacetic acid, 2-cyclohexyl-2-(methylamino)acetic acid, cyclohexyl(methylamino)acetic acid, a-(Methylamino)cyclohexaneaceticacid, F80346
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H17NO2 |
| Molecular Weight | 171.12593 g/mol |
| XLogP | -0.5 |
| Topological Polar Surface Area (TPSA) | 49.3 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 171.12593 Da |
| Heavy Atoms | 12 |
| Complexity | 153.0 |
| SMILES | CNC(C1CCCCC1)C(=O)O |
| InChIKey | VBSXCVMRXXJTLX-UHFFFAOYSA-N |
The XLogP value of -0.5 indicates that 2-Cyclohexyl-2-(methylamino)acetic acid is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 49.3 Ų, 2-Cyclohexyl-2-(methylamino)acetic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Cyclohexyl-2-(methylamino)acetic acid has 2 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-Cyclohexyl-2-(methylamino)acetic acid is 1218286-14-6.
The molecular formula of 2-Cyclohexyl-2-(methylamino)acetic acid is C9H17NO2.
The molecular weight of 2-Cyclohexyl-2-(methylamino)acetic acid is 171.12593 g/mol.
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