TL;DR: Coumarin, 6-amino-3-(piperidinocarbonyl)- (CAS 18144-56-4) is a chemical compound with molecular formula C15H16N2O3 and molecular weight 272.1161 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
6-amino-3-(piperidine-1-carbonyl)chromen-2-one
Also Known As: 6-Amino-3-(piperidinocarbonyl)coumarin, COUMARIN, 6-AMINO-3-(PIPERIDINOCARBONYL)-, 6-amino-3-(piperidine-1-carbonyl)chromen-2-one, 6-Amino-3-coumarincarbonyl piperidide, 5-20-03-00447 (Beilstein Handbook Reference)
| Molecular Formula | C15H16N2O3 |
| Molecular Weight | 272.1161 g/mol |
| XLogP | 1.7 |
| Topological Polar Surface Area (TPSA) | 72.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 272.1161 Da |
| Heavy Atoms | 20 |
| Complexity | 440.0 |
| SMILES | C1CCN(CC1)C(=O)C2=CC3=C(C=CC(=C3)N)OC2=O |
| InChIKey | GKRHYIYUFVXEOY-UHFFFAOYSA-N |
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Coumarin, 6-amino-3-(piperidinocarbonyl)-. The TPSA of 72.6 Ų falls within the moderate polarity range, balancing permeability and solubility for Coumarin, 6-amino-3-(piperidinocarbonyl)-. Following Lipinski's Rule of Five, Coumarin, 6-amino-3-(piperidinocarbonyl)- 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 Coumarin, 6-amino-3-(piperidinocarbonyl)- is 18144-56-4.
The molecular formula of Coumarin, 6-amino-3-(piperidinocarbonyl)- is C15H16N2O3.
The molecular weight of Coumarin, 6-amino-3-(piperidinocarbonyl)- is 272.1161 g/mol.
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