(3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone
TL;DR: (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone (CAS 775299-69-9) is a chemical compound with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone
Also Known As: Pyrrolidine,1-[ carbonyl]-, SDCCGMLS-0024964.P002, 3-ethyl-5-methylisoxazol-4-yl pyrrolidinyl ketone, (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone, Pyrrolidine, 1-[(3-ethyl-5-methyl-4-isoxazolyl)carbonyl]- (9CI)
| Molecular Formula | C11H16N2O2 |
|---|---|
| Molecular Weight | 208.12 g/mol |
| LogP | 1.78142 |
| Topological Polar Surface Area | 46.34 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 208.12119 |
| Heavy Atoms | 15 |
| Complexity | 364.66486 |
Chemical Identifiers
| CAS Number | 775299-69-9 |
|---|---|
| SMILES | CCC1=NOC(=C1C(=O)N2CCCC2)C |
Product Overview
(3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone (CAS 775299-69-9), with molecular formula C11H16N2O2 and molecular weight 208.12 g/mol. IUPAC: (3-ethyl-5-methyl-1,2-oxazol-4-yl)-pyrrolidin-1-ylmethanone.
Chemical Property Profile of (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone
Property Insights of (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone
The XLogP value of 1.78142 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone. With a topological polar surface area (TPSA) of 46.34 Ų, (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone has 0 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
Frequently Asked Questions
What is the CAS number of (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone?
The CAS number of (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone is 775299-69-9.
What is the molecular formula of (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone?
The molecular formula of (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone is C11H16N2O2.
What is the molecular weight of (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone?
The molecular weight of (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone is 208.12 g/mol.
Where can I buy (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone?
You can request a quote for (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (3-Ethyl-5-methylisoxazol-4-yl)(pyrrolidin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.