TL;DR: 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide (CAS 101270-36-4) is a chemical compound with molecular formula C16H24N2O4 and molecular weight 308.1736 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide
Also Known As: BAS 06710897, 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide, 3,4,5-trimethoxy-N-[2-(1-pyrrolidinyl)ethyl]benzamide, AO-365/42033247, 3,4,5-Trimethoxy-N-(2-pyrrolidin-1-yl-ethyl)-benzamide
| Molecular Formula | C16H24N2O4 |
| Molecular Weight | 308.1736 g/mol |
| XLogP | 1.6 |
| Topological Polar Surface Area (TPSA) | 60.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 308.1736 Da |
| Heavy Atoms | 22 |
| Complexity | 333.0 |
| SMILES | COC1=CC(=CC(=C1OC)OC)C(=O)NCCN2CCCC2 |
| InChIKey | PKBVRCYCEXZQOA-UHFFFAOYSA-N |
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide. The TPSA of 60.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide. Following Lipinski's Rule of Five, 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide has 1 hydrogen bond donor(s) and 5 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide is 101270-36-4.
The molecular formula of 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide is C16H24N2O4.
The molecular weight of 3,4,5-trimethoxy-N-(2-pyrrolidin-1-ylethyl)benzamide is 308.1736 g/mol.
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