TL;DR: Carbamic acid, methyl-, ester with 3'-hydroxypropionanilide (CAS 17788-11-3) is a chemical compound with molecular formula C11H14N2O3 and molecular weight 222.10045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
[3-(propanoylamino)phenyl] N-methylcarbamate
Also Known As: Propanamide,, Stauffer R 11520, ENT 27,481, Propionanilide, 3-hydroxy-, methylcarbamate, AI3-27481
Top 5 of 1 IPC patent classification(s) from the SureChEMBL global patent database.
| Molecular Formula | C11H14N2O3 |
| Molecular Weight | 222.10045 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 67.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 222.10045 Da |
| Heavy Atoms | 16 |
| Complexity | 256.0 |
| SMILES | CCC(=O)NC1=CC(=CC=C1)OC(=O)NC |
| InChIKey | NMYKXXMNAUVYBV-UHFFFAOYSA-N |
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, methyl-, ester with 3'-hydroxypropionanilide. The TPSA of 67.4 Ų falls within the moderate polarity range, balancing permeability and solubility for Carbamic acid, methyl-, ester with 3'-hydroxypropionanilide. Following Lipinski's Rule of Five, Carbamic acid, methyl-, ester with 3'-hydroxypropionanilide has 2 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 Carbamic acid, methyl-, ester with 3'-hydroxypropionanilide is 17788-11-3.
The molecular formula of Carbamic acid, methyl-, ester with 3'-hydroxypropionanilide is C11H14N2O3.
The molecular weight of Carbamic acid, methyl-, ester with 3'-hydroxypropionanilide is 222.10045 g/mol.
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