TL;DR: 2-Cyclopenten-1-one, 2,5-dihydroxy-5-methyl-3-(1-piperidinyl)- (CAS 34421-11-9) is a chemical compound with molecular formula C11H17NO3 and molecular weight 211.12085 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2,5-dihydroxy-5-methyl-3-piperidin-1-ylcyclopent-2-en-1-one
Also Known As: AI3-31317, 2-Cyclopenten-1-one, 2,5-dihydroxy-5-methyl-3-(1-piperidinyl)-, 2,5-Dihydroxy-5-methyl-3-piperidinocyclopent-2-en-1-one, 2,5-dihydroxy-5-methyl-3-(piperidin-1-yl)cyclopent-2-en-1-one, 2,5-dihydroxy-5-methyl-3-piperidin-1-ylcyclopent-2-en-1-one
Top 5 of 4 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H17NO3 |
| Molecular Weight | 211.12085 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 60.8 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 211.12085 Da |
| Heavy Atoms | 15 |
| Complexity | 318.0 |
| SMILES | CC1(CC(=C(C1=O)O)N2CCCCC2)O |
| InChIKey | HICPSQHUQBAFIQ-UHFFFAOYSA-N |
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Cyclopenten-1-one, 2,5-dihydroxy-5-methyl-3-(1-piperidinyl)-. The TPSA of 60.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Cyclopenten-1-one, 2,5-dihydroxy-5-methyl-3-(1-piperidinyl)-. Following Lipinski's Rule of Five, 2-Cyclopenten-1-one, 2,5-dihydroxy-5-methyl-3-(1-piperidinyl)- has 2 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-Cyclopenten-1-one, 2,5-dihydroxy-5-methyl-3-(1-piperidinyl)- is 34421-11-9.
The molecular formula of 2-Cyclopenten-1-one, 2,5-dihydroxy-5-methyl-3-(1-piperidinyl)- is C11H17NO3.
The molecular weight of 2-Cyclopenten-1-one, 2,5-dihydroxy-5-methyl-3-(1-piperidinyl)- is 211.12085 g/mol.
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