TL;DR: but-2-enedioic acid;3-methoxy-N-[(1-phenylpyrrolidin-2-yl)methyl]propan-1-amine (CAS 142469-86-1) is a chemical compound with molecular formula C19H28N2O5 and molecular weight 364.19983 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
but-2-enedioic acid;3-methoxy-N-[(1-phenylpyrrolidin-2-yl)methyl]propan-1-amine
Also Known As: (-)-N-(3-Methoxypropyl)-1-phenyl-2-pyrrolidinemethanamine fumarate
| Molecular Formula | C19H28N2O5 |
| Molecular Weight | 364.19983 g/mol |
| XLogP | 1.9933 |
| Topological Polar Surface Area (TPSA) | 99.1 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 7 |
| Rotatable Bonds | 9 |
| Exact Mass | 364.19983 Da |
| Heavy Atoms | 26 |
| Complexity | 336.0 |
| SMILES | COCCCNCC1CCCN1C2=CC=CC=C2.C(=CC(=O)O)C(=O)O |
| InChIKey | DMXIUZQCCGCTKM-UHFFFAOYSA-N |
The XLogP value of 1.9933 suggests moderate lipophilicity, balancing water solubility and membrane permeability for but-2-enedioic acid;3-methoxy-N-[(1-phenylpyrrolidin-2-yl)methyl]propan-1-amine. The TPSA of 99.1 Ų falls within the moderate polarity range, balancing permeability and solubility for but-2-enedioic acid;3-methoxy-N-[(1-phenylpyrrolidin-2-yl)methyl]propan-1-amine. Following Lipinski's Rule of Five, but-2-enedioic acid;3-methoxy-N-[(1-phenylpyrrolidin-2-yl)methyl]propan-1-amine has 3 hydrogen bond donor(s) and 7 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of but-2-enedioic acid;3-methoxy-N-[(1-phenylpyrrolidin-2-yl)methyl]propan-1-amine is 142469-86-1.
The molecular formula of but-2-enedioic acid;3-methoxy-N-[(1-phenylpyrrolidin-2-yl)methyl]propan-1-amine is C19H28N2O5.
The molecular weight of but-2-enedioic acid;3-methoxy-N-[(1-phenylpyrrolidin-2-yl)methyl]propan-1-amine is 364.19983 g/mol.
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