n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide
TL;DR: n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide (CAS 135401-54-6) is a chemical compound with molecular formula C11H16N2O2 and molecular weight 208.12119 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-butan-2-yl-5-cyclopropyl-1,2-oxazole-3-carboxamide
Also Known As: IDI1_026353, n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide, N-(sec-butyl)-5-cyclopropyl-3-isoxazolecarboxamide, BRD-A03735794-001-01-3, (5-cyclopropylisoxazol-3-yl)-N-(methylpropyl)carboxamide
Technical Specifications
| Molecular Formula | C11H16N2O2 |
| Molecular Weight | 208.12119 g/mol |
| XLogP | 1.9 |
| Topological Polar Surface Area (TPSA) | 55.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 208.12119 Da |
| Heavy Atoms | 15 |
| Complexity | 241.0 |
| SMILES | CCC(C)NC(=O)C1=NOC(=C1)C2CC2 |
| InChIKey | JGDUMIBAOOVVLK-UHFFFAOYSA-N |
Chemical Property Profile of n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide
Property Insights of n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide
The XLogP value of 1.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide. With a topological polar surface area (TPSA) of 55.1 Ų, n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide has 1 hydrogen bond donor(s) and 3 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-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide?
The CAS number of n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide is 135401-54-6.
What is the molecular formula of n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide?
The molecular formula of n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide is C11H16N2O2.
What is the molecular weight of n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide?
The molecular weight of n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide is 208.12119 g/mol.
Where can I buy n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide?
You can request a quote for n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide?
Yes, CoreyChem provides custom synthesis services for n-(Sec-butyl)-5-cyclopropylisoxazole-3-carboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.