TL;DR: 1-(Cyclopentylamino)-2-methylpropan-2-yl benzoate--hydrogen chloride (1/1) (CAS 67032-24-0) is a chemical compound with molecular formula C16H24ClNO2 and molecular weight 297.14957 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2-benzoyloxy-2-methylpropyl)-cyclopentylazanium chloride
Also Known As: BENZOIC ACID, (2-(CYCLOPENTYLAMINO)-1,1-DIMETHYL)ETHYL ESTER, HYDROCHLORIDE, (2-benzoyloxy-2-methylpropyl)-cyclopentylazanium chloride, (2-benzoyloxy-2-methylpropyl)-cyclopentylazanium;chloride, 1-(Cyclopentylamino)-2-methylpropan-2-yl benzoate--hydrogen chloride (1/1), 2-Propanol, 1-(cyclopentylamino)-2-methyl-, benzoate (ester), hydrochloride
| Molecular Formula | C16H24ClNO2 |
| Molecular Weight | 297.14957 g/mol |
| XLogP | -0.87 |
| Topological Polar Surface Area (TPSA) | 42.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 297.14957 Da |
| Heavy Atoms | 20 |
| Complexity | 289.0 |
| SMILES | CC(C)(C[NH2+]C1CCCC1)OC(=O)C2=CC=CC=C2.[Cl-] |
| InChIKey | KCRNYECHKJVOLP-UHFFFAOYSA-N |
The XLogP value of -0.87 indicates that 1-(Cyclopentylamino)-2-methylpropan-2-yl benzoate--hydrogen chloride (1/1) is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 42.9 Ų, 1-(Cyclopentylamino)-2-methylpropan-2-yl benzoate--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Cyclopentylamino)-2-methylpropan-2-yl benzoate--hydrogen chloride (1/1) has 1 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 1-(Cyclopentylamino)-2-methylpropan-2-yl benzoate--hydrogen chloride (1/1) is 67032-24-0.
The molecular formula of 1-(Cyclopentylamino)-2-methylpropan-2-yl benzoate--hydrogen chloride (1/1) is C16H24ClNO2.
The molecular weight of 1-(Cyclopentylamino)-2-methylpropan-2-yl benzoate--hydrogen chloride (1/1) is 297.14957 g/mol.
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