TL;DR: 3-amino-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carbonitrile (CAS 165066-46-6) is a chemical compound with molecular formula C11H9N3S and molecular weight 215.05171 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-4-thia-2-azatricyclo[7.3.0.03,7]dodeca-1,3(7),5,8-tetraene-5-carbonitrile
Also Known As: 3-amino-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carbonitrile, ZERO/008068, 3-Amino-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridin-2-yl cyanide, 3-amino-2-cyano-5,6-trimethylenethieno<2,3-b>pyridine, 3-amino-2-cyano-5,6-trimethylenethieno[2,3-b]pyridine
| Molecular Formula | C11H9N3S |
| Molecular Weight | 215.05171 g/mol |
| XLogP | 2.8 |
| Topological Polar Surface Area (TPSA) | 90.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 0 |
| Exact Mass | 215.05171 Da |
| Heavy Atoms | 15 |
| Complexity | 310.0 |
| SMILES | C1CC2=CC3=C(N=C2C1)SC(=C3N)C#N |
| InChIKey | BWCIUNYHYANOPV-UHFFFAOYSA-N |
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-amino-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carbonitrile. The TPSA of 90.9 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-amino-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carbonitrile. Following Lipinski's Rule of Five, 3-amino-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carbonitrile 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 3-amino-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carbonitrile is 165066-46-6.
The molecular formula of 3-amino-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carbonitrile is C11H9N3S.
The molecular weight of 3-amino-6,7-dihydro-5H-cyclopenta[b]thieno[3,2-e]pyridine-2-carbonitrile is 215.05171 g/mol.
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