![1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one structure](/static/products/5928/59288-30-1.webp)
1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one
TL;DR: 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one (CAS 59288-30-1) is a chemical compound with molecular formula C13H23NO and molecular weight 209.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-[tert-butyl(prop-2-ynyl)amino]-3,3-dimethylbutan-2-one
Also Known As: ZERO/008298, AB00278359-03, 1-[tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one, 1-[tert-butyl(prop-2-ynyl)amino]-3,3-dimethylbutan-2-one, 1-[Tert-butyl(2-propynyl)amino]-3,3-dimethyl-2-butanone hydrochloride
| Molecular Formula | C13H23NO |
|---|---|
| Molecular Weight | 209.18 g/mol |
| LogP | 2.3353 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 209.17796 |
| Heavy Atoms | 15 |
| Complexity | 259.7312 |
Chemical Identifiers
| CAS Number | 59288-30-1 |
|---|---|
| SMILES | CC(C)(C)C(=O)CN(CC#C)C(C)(C)C |
Product Overview
1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one (CAS 59288-30-1), with molecular formula C13H23NO and molecular weight 209.18 g/mol. IUPAC: 1-[tert-butyl(prop-2-ynyl)amino]-3,3-dimethylbutan-2-one.
Chemical Property Profile of 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one
Property Insights of 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one
The XLogP value of 2.3353 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one. With a topological polar surface area (TPSA) of 20.31 Ų, 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one has 0 hydrogen bond donor(s) and 2 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 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one?
The CAS number of 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one is 59288-30-1.
What is the molecular formula of 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one?
The molecular formula of 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one is C13H23NO.
What is the molecular weight of 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one?
The molecular weight of 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one is 209.18 g/mol.
Where can I buy 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one?
You can request a quote for 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one?
Yes, KEHONG BIO provides custom synthesis services for 1-[Tert-butyl(prop-2-yn-1-yl)amino]-3,3-dimethylbutan-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.