TL;DR: N-[[1-(2-prop-2-ynoxyethyl)pyridin-1-ium-2-yl]methylidene]hydroxylamine chloride (CAS 131524-41-9) is a chemical compound with molecular formula C11H13ClN2O2 and molecular weight 240.06656 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-[[1-(2-prop-2-ynoxyethyl)pyridin-1-ium-2-yl]methylidene]hydroxylamine chloride
Also Known As: oxo-[(E)-[1-(2-prop-2-ynoxyethyl)pyridin-2-ylidene]methyl]az
| Molecular Formula | C11H13ClN2O2 |
| Molecular Weight | 240.06656 g/mol |
| XLogP | -2.564 |
| Topological Polar Surface Area (TPSA) | 45.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 240.06656 Da |
| Heavy Atoms | 16 |
| Complexity | 244.0 |
| SMILES | C#CCOCC[N+]1=CC=CC=C1C=NO.[Cl-] |
| InChIKey | WANQQCAHJJWHQC-UHFFFAOYSA-N |
The XLogP value of -2.564 indicates that N-[[1-(2-prop-2-ynoxyethyl)pyridin-1-ium-2-yl]methylidene]hydroxylamine chloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 45.7 Ų, N-[[1-(2-prop-2-ynoxyethyl)pyridin-1-ium-2-yl]methylidene]hydroxylamine chloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[[1-(2-prop-2-ynoxyethyl)pyridin-1-ium-2-yl]methylidene]hydroxylamine chloride has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of N-[[1-(2-prop-2-ynoxyethyl)pyridin-1-ium-2-yl]methylidene]hydroxylamine chloride is 131524-41-9.
The molecular formula of N-[[1-(2-prop-2-ynoxyethyl)pyridin-1-ium-2-yl]methylidene]hydroxylamine chloride is C11H13ClN2O2.
The molecular weight of N-[[1-(2-prop-2-ynoxyethyl)pyridin-1-ium-2-yl]methylidene]hydroxylamine chloride is 240.06656 g/mol.
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