TL;DR: 2-(Piperidin-1-yl)ethyl {2-[(pentyloxy)methyl]phenyl}carbamate (CAS 93450-05-6) is a chemical compound with molecular formula C20H32N2O3 and molecular weight 348.2413 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-piperidin-1-ylethyl N-[2-(pentoxymethyl)phenyl]carbamate
Also Known As: J1.539.245B, 2-(1-piperidyl)ethyl N-[2-(pentoxymethyl)phenyl]carbamate, 2-piperidin-1-ylethyl N-[2-(pentoxymethyl)phenyl]carbamate, N-[2-(Pentyloxymethyl)phenyl]carbamic acid 2-piperidinoethyl ester, 2-(piperidin-1-yl)ethyl{2-[(pentyloxy)methyl]phenyl}carbamate
| Molecular Formula | C20H32N2O3 |
| Molecular Weight | 348.2413 g/mol |
| XLogP | 4.5 |
| Topological Polar Surface Area (TPSA) | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 11 |
| Exact Mass | 348.2413 Da |
| Heavy Atoms | 25 |
| Complexity | 359.0 |
| SMILES | CCCCCOCC1=CC=CC=C1NC(=O)OCCN2CCCCC2 |
| InChIKey | CVFRDSWFPBPNII-UHFFFAOYSA-N |
The XLogP value of 4.5 indicates that 2-(Piperidin-1-yl)ethyl {2-[(pentyloxy)methyl]phenyl}carbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 50.8 Ų, 2-(Piperidin-1-yl)ethyl {2-[(pentyloxy)methyl]phenyl}carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Piperidin-1-yl)ethyl {2-[(pentyloxy)methyl]phenyl}carbamate has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 2-(Piperidin-1-yl)ethyl {2-[(pentyloxy)methyl]phenyl}carbamate is 93450-05-6.
The molecular formula of 2-(Piperidin-1-yl)ethyl {2-[(pentyloxy)methyl]phenyl}carbamate is C20H32N2O3.
The molecular weight of 2-(Piperidin-1-yl)ethyl {2-[(pentyloxy)methyl]phenyl}carbamate is 348.2413 g/mol.
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