![N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide structure](/static/products/956/956756-05-1.webp)
N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide
TL;DR: N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide (CAS 956756-05-1) is a chemical compound with molecular formula C10H16ClN3O and molecular weight 229.09819 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(2-butan-2-ylpyrazol-3-yl)-2-chloropropanamide
Also Known As: N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide, N-(1-sec-butyl-1H-pyrazol-5-yl)-2-chloropropanamide, N-(2-butan-2-ylpyrazol-3-yl)-2-chloropropanamide, 2-chloro-N-(2-sec-butylpyrazol-3-yl)propanamide, 2-CHLORO-N-[2-(SEC-BUTYL)PYRAZOL-3-YL]PROPANAMIDE
Technical Specifications
| Molecular Formula | C10H16ClN3O |
| Molecular Weight | 229.09819 g/mol |
| XLogP | 2.0 |
| Topological Polar Surface Area (TPSA) | 46.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 229.09819 Da |
| Heavy Atoms | 15 |
| Complexity | 225.0 |
| SMILES | CCC(C)N1C(=CC=N1)NC(=O)C(C)Cl |
| InChIKey | QDHSSHZCWDNOQE-UHFFFAOYSA-N |
Chemical Property Profile of N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide
Property Insights of N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide. With a topological polar surface area (TPSA) of 46.9 Ų, N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide 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 N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide?
The CAS number of N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide is 956756-05-1.
What is the molecular formula of N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide?
The molecular formula of N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide is C10H16ClN3O.
What is the molecular weight of N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide?
The molecular weight of N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide is 229.09819 g/mol.
Where can I buy N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide?
You can request a quote for N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide?
Yes, CoreyChem provides custom synthesis services for N-[1-(butan-2-yl)-1H-pyrazol-5-yl]-2-chloropropanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.