TL;DR: 3-Pyridinecarboxamide, N,N-diethyl-5-phenyl- (CAS 10211-39-9) is a chemical compound with molecular formula C16H18N2O and molecular weight 254.1419 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N,N-diethyl-5-phenylpyridine-3-carboxamide
Also Known As: 3-Pyridinecarboxamide, N,N-diethyl-5-phenyl-, N,N-Diethyl-5-phenyl-3-pyridinecarboxamide, N,N-diethyl-5-phenylpyridine-3-carboxamide, 5-22-03-00323 (Beilstein Handbook Reference), BRN 0399902
| Molecular Formula | C16H18N2O |
| Molecular Weight | 254.1419 g/mol |
| XLogP | 2.7 |
| Topological Polar Surface Area (TPSA) | 33.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 254.1419 Da |
| Heavy Atoms | 19 |
| Complexity | 282.0 |
| SMILES | CCN(CC)C(=O)C1=CN=CC(=C1)C2=CC=CC=C2 |
| InChIKey | UMBKIZJZONTRIS-UHFFFAOYSA-N |
The XLogP value of 2.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pyridinecarboxamide, N,N-diethyl-5-phenyl-. With a topological polar surface area (TPSA) of 33.2 Ų, 3-Pyridinecarboxamide, N,N-diethyl-5-phenyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pyridinecarboxamide, N,N-diethyl-5-phenyl- has 0 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
The CAS number of 3-Pyridinecarboxamide, N,N-diethyl-5-phenyl- is 10211-39-9.
The molecular formula of 3-Pyridinecarboxamide, N,N-diethyl-5-phenyl- is C16H18N2O.
The molecular weight of 3-Pyridinecarboxamide, N,N-diethyl-5-phenyl- is 254.1419 g/mol.
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