N-Isopropylbutyramide
TL;DR: N-Isopropylbutyramide (CAS 122348-67-8) is a chemical compound with molecular formula C7H15NO and molecular weight 129.11537 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-propan-2-ylbutanamide
Also Known As: N-Isopropylbutyramide, N-propan-2-ylbutanamide, Butanamide, N-isopropyl, Butanamide, N-(1-methylethyl)-, N-(propan-2-yl)butanamide
Application Areas
Top 5 of 5 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H15NO |
| Molecular Weight | 129.11537 g/mol |
| XLogP | 1.2 |
| Topological Polar Surface Area (TPSA) | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 129.11537 Da |
| Heavy Atoms | 9 |
| Complexity | 88.0 |
| SMILES | CCCC(=O)NC(C)C |
| InChIKey | KKWNADDVIBLENW-UHFFFAOYSA-N |
Chemical Property Profile of N-Isopropylbutyramide
Property Insights of N-Isopropylbutyramide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Isopropylbutyramide. With a topological polar surface area (TPSA) of 29.1 Ų, N-Isopropylbutyramide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Isopropylbutyramide has 1 hydrogen bond donor(s) and 1 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of N-Isopropylbutyramide?
The CAS number of N-Isopropylbutyramide is 122348-67-8.
What is the molecular formula of N-Isopropylbutyramide?
The molecular formula of N-Isopropylbutyramide is C7H15NO.
What is the molecular weight of N-Isopropylbutyramide?
The molecular weight of N-Isopropylbutyramide is 129.11537 g/mol.
Where can I buy N-Isopropylbutyramide?
You can request a quote for N-Isopropylbutyramide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-Isopropylbutyramide?
Yes, CoreyChem provides custom synthesis services for N-Isopropylbutyramide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.