TL;DR: Cyclopentanone, 2-heptylidene-5-(1-pyrrolidinylmethyl)-, (E)-, hydrochloride (CAS 162190-88-7) is a chemical compound with molecular formula C17H30ClNO and molecular weight 299.2016 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-heptylidene-5-(pyrrolidin-1-ylmethyl)cyclopentan-1-one;hydrochloride
Also Known As: 2-heptylidene-5-(pyrrolidin-1-ylmethyl)cyclopentan-1-one hydrochloride, Cyclopentanone, 2-heptylidene-5-(1-pyrrolidinylmethyl)-, (E)-, hydrochloride, Cyclopentanone,2-heptylidene-5-(1-pyrrolidinylmethyl)-, hydrochloride, (E)- (9CI)
| Molecular Formula | C17H30ClNO |
| Molecular Weight | 299.2016 g/mol |
| XLogP | 4.3799 |
| Topological Polar Surface Area (TPSA) | 20.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 7 |
| Exact Mass | 299.2016 Da |
| Heavy Atoms | 20 |
| Complexity | 315.0 |
| SMILES | CCCCCCC=C1CCC(C1=O)CN2CCCC2.Cl |
| InChIKey | INFJGXMCBQDLQE-UHFFFAOYSA-N |
The XLogP value of 4.3799 indicates that Cyclopentanone, 2-heptylidene-5-(1-pyrrolidinylmethyl)-, (E)-, hydrochloride is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 20.3 Ų, Cyclopentanone, 2-heptylidene-5-(1-pyrrolidinylmethyl)-, (E)-, hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Cyclopentanone, 2-heptylidene-5-(1-pyrrolidinylmethyl)-, (E)-, hydrochloride 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 Cyclopentanone, 2-heptylidene-5-(1-pyrrolidinylmethyl)-, (E)-, hydrochloride is 162190-88-7.
The molecular formula of Cyclopentanone, 2-heptylidene-5-(1-pyrrolidinylmethyl)-, (E)-, hydrochloride is C17H30ClNO.
The molecular weight of Cyclopentanone, 2-heptylidene-5-(1-pyrrolidinylmethyl)-, (E)-, hydrochloride is 299.2016 g/mol.
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