TL;DR: Pyrrolidin-1-yl(pyrrolidin-2-yl)methanone (CAS 1236267-58-5) is a chemical compound with molecular formula C9H16N2O and molecular weight 168.12627 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
pyrrolidin-1-yl(pyrrolidin-2-yl)methanone
Also Known As: pyrrolidin-1-yl(pyrrolidin-2-yl)methanone, Pyrrolidine,1- -, 1-[(Pyrrolidin-2-yl)carbonyl]pyrrolidine, 2-(pyrrolidine-1-carbonyl)pyrrolidine, 2-(1-pyrrolidinyl)carbonylpyrrolidine
Top 5 of 6 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C9H16N2O |
| Molecular Weight | 168.12627 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 32.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 168.12627 Da |
| Heavy Atoms | 12 |
| Complexity | 175.0 |
| SMILES | C1CCN(C1)C(=O)C2CCCN2 |
| InChIKey | HDLWINONZUFKQV-UHFFFAOYSA-N |
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Pyrrolidin-1-yl(pyrrolidin-2-yl)methanone. With a topological polar surface area (TPSA) of 32.3 Ų, Pyrrolidin-1-yl(pyrrolidin-2-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Pyrrolidin-1-yl(pyrrolidin-2-yl)methanone 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 Pyrrolidin-1-yl(pyrrolidin-2-yl)methanone is 1236267-58-5.
The molecular formula of Pyrrolidin-1-yl(pyrrolidin-2-yl)methanone is C9H16N2O.
The molecular weight of Pyrrolidin-1-yl(pyrrolidin-2-yl)methanone is 168.12627 g/mol.
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