TL;DR: 2-(3-Phenylprop-2-enoylamino)ethyl carbamate (CAS 30687-12-8) is a chemical compound with molecular formula C12H14N2O3 and molecular weight 234.10045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-(3-phenylprop-2-enoylamino)ethyl carbamate
Also Known As: 2-[[(E)-3-phenylprop-2-enoyl]amino]ethyl carbamate
| Molecular Formula | C12H14N2O3 |
| Molecular Weight | 234.10045 g/mol |
| XLogP | 0.9 |
| Topological Polar Surface Area (TPSA) | 81.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 234.10045 Da |
| Heavy Atoms | 17 |
| Complexity | 283.0 |
| SMILES | C1=CC=C(C=C1)C=CC(=O)NCCOC(=O)N |
| InChIKey | OPIPXANXUZVCGB-UHFFFAOYSA-N |
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3-Phenylprop-2-enoylamino)ethyl carbamate. The TPSA of 81.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-(3-Phenylprop-2-enoylamino)ethyl carbamate. Following Lipinski's Rule of Five, 2-(3-Phenylprop-2-enoylamino)ethyl carbamate 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 2-(3-Phenylprop-2-enoylamino)ethyl carbamate is 30687-12-8.
The molecular formula of 2-(3-Phenylprop-2-enoylamino)ethyl carbamate is C12H14N2O3.
The molecular weight of 2-(3-Phenylprop-2-enoylamino)ethyl carbamate is 234.10045 g/mol.
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