TL;DR: N-(p-(Aminomethyl)-alpha-(pyrrolidinocarbonyl)phenethyl)-2-naphthalenesulfonamide (CAS 109006-05-5) is a chemical compound with molecular formula C24H27N3O3S and molecular weight 437.1773 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[3-[4-(aminomethyl)phenyl]-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]naphthalene-2-sulfonamide
Also Known As: N-(p-(Aminomethyl)-alpha-(pyrrolidinocarbonyl)phenethyl)-2-naphthalenesulfonamide, 2-Naphthalenesulfonamide, N-(p-(aminomethyl)-alpha-(pyrrolidinocarbonyl)phenethyl)-, Pyrrolidine, 1-(3-(4-(aminomethyl)phenyl)-2-((2-naphthalenylsulfonyl)amino)-1-oxopropyl)-, N-[3-[4-(aminomethyl)phenyl]-1-oxo-1-pyrrolidin-1-ylpropan-2-yl]naphthalene-2-sulfonamide, N-{3-[4-(Aminomethyl)phenyl]-1-oxo-1-(pyrrolidin-1-yl)propan-2-yl}naphthalene-2-sulfonamide
| Molecular Formula | C24H27N3O3S |
| Molecular Weight | 437.1773 g/mol |
| XLogP | 3.0 |
| Topological Polar Surface Area (TPSA) | 101.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 7 |
| Exact Mass | 437.1773 Da |
| Heavy Atoms | 31 |
| Complexity | 693.0 |
| SMILES | C1CCN(C1)C(=O)C(CC2=CC=C(C=C2)CN)NS(=O)(=O)C3=CC4=CC=CC=C4C=C3 |
| InChIKey | JRPYOHXZWUOKAD-UHFFFAOYSA-N |
The XLogP value of 3.0 indicates that N-(p-(Aminomethyl)-alpha-(pyrrolidinocarbonyl)phenethyl)-2-naphthalenesulfonamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 101.0 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(p-(Aminomethyl)-alpha-(pyrrolidinocarbonyl)phenethyl)-2-naphthalenesulfonamide. Following Lipinski's Rule of Five, N-(p-(Aminomethyl)-alpha-(pyrrolidinocarbonyl)phenethyl)-2-naphthalenesulfonamide has 2 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 N-(p-(Aminomethyl)-alpha-(pyrrolidinocarbonyl)phenethyl)-2-naphthalenesulfonamide is 109006-05-5.
The molecular formula of N-(p-(Aminomethyl)-alpha-(pyrrolidinocarbonyl)phenethyl)-2-naphthalenesulfonamide is C24H27N3O3S.
The molecular weight of N-(p-(Aminomethyl)-alpha-(pyrrolidinocarbonyl)phenethyl)-2-naphthalenesulfonamide is 437.1773 g/mol.
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