Isopropyl 5-bromonicotinamide
TL;DR: Isopropyl 5-bromonicotinamide (CAS 104290-45-1) is a chemical compound with molecular formula C9H11BrN2O and molecular weight 242.00548 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
5-bromo-N-propan-2-ylpyridine-3-carboxamide
Also Known As: ISOPROPYL 5-BROMONICOTINAMIDE, 5-Bromo-N-isopropylnicotinamide, 5-bromo-N-propan-2-ylpyridine-3-carboxamide, 5-bromo-N-(propan-2-yl)pyridine-3-carboxamide, 5-bromo-N-isopropyl-pyridine-3-carboxamide
Technical Specifications
| Molecular Formula | C9H11BrN2O |
| Molecular Weight | 242.00548 g/mol |
| XLogP | 1.3 |
| Topological Polar Surface Area (TPSA) | 42.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 242.00548 Da |
| Heavy Atoms | 13 |
| Complexity | 184.0 |
| SMILES | CC(C)NC(=O)C1=CC(=CN=C1)Br |
| InChIKey | IONIYOWDLSXKNQ-UHFFFAOYSA-N |
Chemical Property Profile of Isopropyl 5-bromonicotinamide
Property Insights of Isopropyl 5-bromonicotinamide
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Isopropyl 5-bromonicotinamide. With a topological polar surface area (TPSA) of 42.0 Ų, Isopropyl 5-bromonicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Isopropyl 5-bromonicotinamide has 1 hydrogen bond donor(s) and 2 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Isopropyl 5-bromonicotinamide?
The CAS number of Isopropyl 5-bromonicotinamide is 104290-45-1.
What is the molecular formula of Isopropyl 5-bromonicotinamide?
The molecular formula of Isopropyl 5-bromonicotinamide is C9H11BrN2O.
What is the molecular weight of Isopropyl 5-bromonicotinamide?
The molecular weight of Isopropyl 5-bromonicotinamide is 242.00548 g/mol.
Where can I buy Isopropyl 5-bromonicotinamide?
You can request a quote for Isopropyl 5-bromonicotinamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Isopropyl 5-bromonicotinamide?
Yes, CoreyChem provides custom synthesis services for Isopropyl 5-bromonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.