TL;DR: 1-Propenyl-pyrrolidine (CAS 13937-88-7) is a chemical compound with molecular formula C7H13N and molecular weight 111.1048 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-prop-1-enylpyrrolidine
Also Known As: 1-propenyl-pyrrolidine, 1-prop-1-enylpyrrolidine, Pyrrolidine, 1-propenyl-, 1-(1-Pyrrolidinyl)-1-propene, N-(1-propenyl)pyrrolidine
Top 5 of 3 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C7H13N |
| Molecular Weight | 111.1048 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 111.1048 Da |
| Heavy Atoms | 8 |
| Complexity | 80.0 |
| SMILES | CC=CN1CCCC1 |
| InChIKey | KORJOGPPKPWOLT-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Propenyl-pyrrolidine. With a topological polar surface area (TPSA) of 3.2 Ų, 1-Propenyl-pyrrolidine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Propenyl-pyrrolidine has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 1-Propenyl-pyrrolidine is 13937-88-7.
The molecular formula of 1-Propenyl-pyrrolidine is C7H13N.
The molecular weight of 1-Propenyl-pyrrolidine is 111.1048 g/mol.
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