TL;DR: CH3CH=Chn(CH3)2 (CAS 13222-51-0) is a chemical compound with molecular formula C5H11N and molecular weight 85.08915 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
(E)-N,N-dimethylprop-1-en-1-amine
Also Known As: N-Dimethylpropenylamin, 1-Propenyldimethylamine, CH3CH=CHN(CH3)2, (E)-1-(Dimethylamino)propene, 1-(Dimethylamino)-1-propene
| Molecular Formula | C5H11N |
| Molecular Weight | 85.08915 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 85.08915 Da |
| Heavy Atoms | 6 |
| Complexity | 45.0 |
| SMILES | C/C=C/N(C)C |
| InChIKey | NXBBFAKHXAMPOM-SNAWJCMRSA-N |
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for CH3CH=Chn(CH3)2. With a topological polar surface area (TPSA) of 3.2 Ų, CH3CH=Chn(CH3)2 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, CH3CH=Chn(CH3)2 has 0 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of CH3CH=Chn(CH3)2 is 13222-51-0.
The molecular formula of CH3CH=Chn(CH3)2 is C5H11N.
The molecular weight of CH3CH=Chn(CH3)2 is 85.08915 g/mol.
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