TL;DR: Pentyl carbamate (CAS 638-42-6) is a chemical compound with molecular formula C6H13NO2 and molecular weight 131.09464 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pentyl carbamate
Also Known As: Pentyl carbamate, Amyl carbamate, n-pentyl carbamate, Carbamic acid amyl, Carbamicacidamylester
Top 5 of 21 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C6H13NO2 |
| Molecular Weight | 131.09464 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 52.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 131.09464 Da |
| Heavy Atoms | 9 |
| Complexity | 83.0 |
| SMILES | CCCCCOC(=O)N |
| InChIKey | MYDQAEQZZKVJSL-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pentyl carbamate. With a topological polar surface area (TPSA) of 52.3 Ų, Pentyl carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentyl carbamate has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of Pentyl carbamate is 638-42-6.
The molecular formula of Pentyl carbamate is C6H13NO2.
The molecular weight of Pentyl carbamate is 131.09464 g/mol.
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