TL;DR: 5-nitro-2-(1H-pyrrol-1-yl)pyridine (CAS 157842-34-7) is a chemical compound with molecular formula C9H7N3O2 and molecular weight 189.05383 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-nitro-2-pyrrol-1-ylpyridine
Also Known As: 5-nitro-2-(1H-pyrrol-1-yl)pyridine, 5-nitro-2-pyrrol-1-ylpyridine, 5-nitro-2-pyrrol-1-yl-pyridine, HY-W224855, 5-NITRO-2-(PYRROL-1-YL)PYRIDINE
| Molecular Formula | C9H7N3O2 |
| Molecular Weight | 189.05383 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 63.6 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 189.05383 Da |
| Heavy Atoms | 14 |
| Complexity | 211.0 |
| SMILES | C1=CN(C=C1)C2=NC=C(C=C2)[N+](=O)[O-] |
| InChIKey | KKUKCVWCVBNWBG-UHFFFAOYSA-N |
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-nitro-2-(1H-pyrrol-1-yl)pyridine. The TPSA of 63.6 Ų falls within the moderate polarity range, balancing permeability and solubility for 5-nitro-2-(1H-pyrrol-1-yl)pyridine. Following Lipinski's Rule of Five, 5-nitro-2-(1H-pyrrol-1-yl)pyridine has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 5-nitro-2-(1H-pyrrol-1-yl)pyridine is 157842-34-7.
The molecular formula of 5-nitro-2-(1H-pyrrol-1-yl)pyridine is C9H7N3O2.
The molecular weight of 5-nitro-2-(1H-pyrrol-1-yl)pyridine is 189.05383 g/mol.
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