TL;DR: 3-(Dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid (CAS 1005121-21-0) is a chemical compound with molecular formula C15H23NO3 and molecular weight 265.1678 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-(dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid
Also Known As: 3-(dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid, 2-(dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-3-carboxylic acid, 3-(dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylicacid, G20170
| Molecular Formula | C15H23NO3 |
| Molecular Weight | 265.1678 g/mol |
| XLogP | 2.1 |
| Topological Polar Surface Area (TPSA) | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 265.1678 Da |
| Heavy Atoms | 19 |
| Complexity | 385.0 |
| SMILES | CCCN(CCC)C(=O)C1C2CC(C1C(=O)O)C=C2 |
| InChIKey | YWDXIUFEAZXPBZ-UHFFFAOYSA-N |
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid. With a topological polar surface area (TPSA) of 57.6 Ų, 3-(Dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid 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 3-(Dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid is 1005121-21-0.
The molecular formula of 3-(Dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid is C15H23NO3.
The molecular weight of 3-(Dipropylcarbamoyl)bicyclo[2.2.1]hept-5-ene-2-carboxylic acid is 265.1678 g/mol.
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