TL;DR: (1-Methyl-1H-pyrrol-2-ylmethyl)-pyridin-3-ylmethyl-amine hydrochloride (CAS 1052415-16-3) is a chemical compound with molecular formula C12H16ClN3 and molecular weight 237.10327 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[(1-methylpyrrol-2-yl)methyl]-1-pyridin-3-ylmethanamine;hydrochloride
Also Known As: (1-METHYL-1H-PYRROL-2-YLMETHYL)-PYRIDIN-3-YLMETHYL-AMINE HYDROCHLORIDE, [(1-methylpyrrol-2-yl)methyl](pyridin-3-ylmethyl)amine hydrochloride, N-[(1-methylpyrrol-2-yl)methyl]-1-pyridin-3-ylmethanamine;hydrochloride, 1-(1-methylpyrrol-2-yl)-N-(pyridin-3-ylmethyl)methanamine Hydrochloride, N-[(1-methylpyrrol-2-yl)methyl]-1-pyridin-3-ylmethanamine hydrochloride
| Molecular Formula | C12H16ClN3 |
| Molecular Weight | 237.10327 g/mol |
| XLogP | 2.1317 |
| Topological Polar Surface Area (TPSA) | 29.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 237.10327 Da |
| Heavy Atoms | 16 |
| Complexity | 184.0 |
| SMILES | CN1C=CC=C1CNCC2=CN=CC=C2.Cl |
| InChIKey | GNNZTLNTWLVGBQ-UHFFFAOYSA-N |
The XLogP value of 2.1317 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (1-Methyl-1H-pyrrol-2-ylmethyl)-pyridin-3-ylmethyl-amine hydrochloride. With a topological polar surface area (TPSA) of 29.9 Ų, (1-Methyl-1H-pyrrol-2-ylmethyl)-pyridin-3-ylmethyl-amine hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (1-Methyl-1H-pyrrol-2-ylmethyl)-pyridin-3-ylmethyl-amine hydrochloride has 2 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 (1-Methyl-1H-pyrrol-2-ylmethyl)-pyridin-3-ylmethyl-amine hydrochloride is 1052415-16-3.
The molecular formula of (1-Methyl-1H-pyrrol-2-ylmethyl)-pyridin-3-ylmethyl-amine hydrochloride is C12H16ClN3.
The molecular weight of (1-Methyl-1H-pyrrol-2-ylmethyl)-pyridin-3-ylmethyl-amine hydrochloride is 237.10327 g/mol.
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