TL;DR: (S)-N,3-Dimethyl-1-(pyrrolidin-1-YL)butan-2-amine (CAS 156004-66-9) is a chemical compound with molecular formula C10H22N2 and molecular weight 170.1783 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(2S)-N,3-dimethyl-1-pyrrolidin-1-ylbutan-2-amine
Also Known As: (S)-N,3-DIMETHYL-1-(PYRROLIDIN-1-YL)BUTAN-2-AMINE, (2S)-N,3-dimethyl-1-pyrrolidin-1-ylbutan-2-amine, (S)-N-methyl-1-isopropyl-2-pyrrolidinoethanamine, (S)-N-Methyl-1-isopropyl-2-pyrrolizinoethanamine, 1-<(2S)-3-methyl-2-(methylamino)butyl>pyrrolidine
| Molecular Formula | C10H22N2 |
| Molecular Weight | 170.1783 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 170.1783 Da |
| Heavy Atoms | 12 |
| Complexity | 117.0 |
| SMILES | CC(C)[C@@H](CN1CCCC1)NC |
| InChIKey | ZIDNRUFGAGPXNN-SNVBAGLBSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (S)-N,3-Dimethyl-1-(pyrrolidin-1-YL)butan-2-amine. With a topological polar surface area (TPSA) of 15.3 Ų, (S)-N,3-Dimethyl-1-(pyrrolidin-1-YL)butan-2-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (S)-N,3-Dimethyl-1-(pyrrolidin-1-YL)butan-2-amine has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of (S)-N,3-Dimethyl-1-(pyrrolidin-1-YL)butan-2-amine is 156004-66-9.
The molecular formula of (S)-N,3-Dimethyl-1-(pyrrolidin-1-YL)butan-2-amine is C10H22N2.
The molecular weight of (S)-N,3-Dimethyl-1-(pyrrolidin-1-YL)butan-2-amine is 170.1783 g/mol.
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