TL;DR: 1-(Piperidin-1-yl)propan-2-yl (4-butoxy-2-methylphenyl)carbamate (CAS 63986-59-4) 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.
1-piperidin-1-ylpropan-2-yl N-(4-butoxy-2-methylphenyl)carbamate
Also Known As: KL 3633, 1-(Piperidinomethyl)ethyl 4-butoxy-2-methylcarbanilate, 1-piperidin-1-ylpropan-2-yl N-(4-butoxy-2-methylphenyl)carbamate, 4-Butoxy-2-methylcarbanilic acid 1-(piperidinomethyl)ethyl ester, CARBANILIC ACID, 4-BUTOXY-2-METHYL-, 1-(PIPERIDINOMETHYL)ETHYL ESTER
| Molecular Formula | C20H32N2O3 |
| Molecular Weight | 348.2413 g/mol |
| XLogP | 4.4 |
| Topological Polar Surface Area (TPSA) | 50.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 9 |
| Exact Mass | 348.2413 Da |
| Heavy Atoms | 25 |
| Complexity | 385.0 |
| SMILES | CCCCOC1=CC(=C(C=C1)NC(=O)OC(C)CN2CCCCC2)C |
| InChIKey | FEMVZCRCQVTNMD-UHFFFAOYSA-N |
The XLogP value of 4.4 indicates that 1-(Piperidin-1-yl)propan-2-yl (4-butoxy-2-methylphenyl)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, 1-(Piperidin-1-yl)propan-2-yl (4-butoxy-2-methylphenyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Piperidin-1-yl)propan-2-yl (4-butoxy-2-methylphenyl)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 1-(Piperidin-1-yl)propan-2-yl (4-butoxy-2-methylphenyl)carbamate is 63986-59-4.
The molecular formula of 1-(Piperidin-1-yl)propan-2-yl (4-butoxy-2-methylphenyl)carbamate is C20H32N2O3.
The molecular weight of 1-(Piperidin-1-yl)propan-2-yl (4-butoxy-2-methylphenyl)carbamate is 348.2413 g/mol.
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