TL;DR: Butyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine (CAS 142920-56-7) is a chemical compound with molecular formula C10H18N2 and molecular weight 166.147 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(1-methylpyrrol-2-yl)methyl]butan-1-amine
Also Known As: Butyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine, N-[(1-methylpyrrol-2-yl)methyl]butan-1-amine, butyl(1-methyl-1H-pyrrol-2-yl)methylamine, butyl-[(1-methyl-1H-pyrrol-2-yl)-methyl]-amine, N-((1-methyl-1H-pyrrol-2-yl)methyl)butan-1-amine
| Molecular Formula | C10H18N2 |
| Molecular Weight | 166.147 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 17.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 166.147 Da |
| Heavy Atoms | 12 |
| Complexity | 114.0 |
| SMILES | CCCCNCC1=CC=CN1C |
| InChIKey | RXKWPINKZUKOKE-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine. With a topological polar surface area (TPSA) of 17.0 Ų, Butyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Butyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine has 1 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 Butyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine is 142920-56-7.
The molecular formula of Butyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine is C10H18N2.
The molecular weight of Butyl[(1-methyl-1H-pyrrol-2-yl)methyl]amine is 166.147 g/mol.
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