TL;DR: Pentanoic acid, 4-(1-piperidinyl)cyclohexyl ester (CAS 1532-02-1) is a chemical compound with molecular formula C16H29NO2 and molecular weight 267.21982 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(4-piperidin-1-ylcyclohexyl) pentanoate
Also Known As: 4-Piperidinocyclohexyl valerate, 4-Piperidinocyclohexylvalerate, Cyclohexanol, 4-piperidino-, valerate, (4-piperidin-1-ylcyclohexyl) pentanoate, Valeric acid, 4-piperidinocyclohexyl ester
| Molecular Formula | C16H29NO2 |
| Molecular Weight | 267.21982 g/mol |
| XLogP | 3.7 |
| Topological Polar Surface Area (TPSA) | 29.5 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 267.21982 Da |
| Heavy Atoms | 19 |
| Complexity | 266.0 |
| SMILES | CCCCC(=O)OC1CCC(CC1)N2CCCCC2 |
| InChIKey | BELYKPLCHUFRRA-UHFFFAOYSA-N |
The XLogP value of 3.7 indicates that Pentanoic acid, 4-(1-piperidinyl)cyclohexyl ester is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 29.5 Ų, Pentanoic acid, 4-(1-piperidinyl)cyclohexyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pentanoic acid, 4-(1-piperidinyl)cyclohexyl ester has 0 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 Pentanoic acid, 4-(1-piperidinyl)cyclohexyl ester is 1532-02-1.
The molecular formula of Pentanoic acid, 4-(1-piperidinyl)cyclohexyl ester is C16H29NO2.
The molecular weight of Pentanoic acid, 4-(1-piperidinyl)cyclohexyl ester is 267.21982 g/mol.
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