1,1-Dimethyl-N-tert-octylpropargylamine
TL;DR: 1,1-Dimethyl-N-tert-octylpropargylamine (CAS 263254-99-5) is a chemical compound with molecular formula C13H25N and molecular weight 195.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,4,4-trimethyl-N-(2-methylbut-3-yn-2-yl)pentan-2-amine
Also Known As: 1,1-Dimethyl-N-tert-octylpropargylamine, 2,4,4-trimethyl-N-(2-methylbut-3-yn-2-yl)pentan-2-amine, 1 1-DIMETHYL-N-TERT-OCTYLPROPARGYLAMINE&, (2-METHYLBUT-3-YN-2-YL)(2,4,4-TRIMETHYLPENTAN-2-YL)AMINE, 2-Pentanamine, N-(1,1-dimethyl-2-propyn-1-yl)-2,4,4-trimethyl-
| Molecular Formula | C13H25N |
|---|---|
| Molecular Weight | 195.20 g/mol |
| LogP | 3.2026 |
| Topological Polar Surface Area | 12.03 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 195.1987 |
| Heavy Atoms | 14 |
| Complexity | 222.60057 |
Chemical Identifiers
| CAS Number | 263254-99-5 |
|---|---|
| SMILES | CC(C)(C)CC(C)(C)NC(C)(C)C#C |
Product Overview
1,1-Dimethyl-N-tert-octylpropargylamine (CAS 263254-99-5), with molecular formula C13H25N and molecular weight 195.20 g/mol. IUPAC: 2,4,4-trimethyl-N-(2-methylbut-3-yn-2-yl)pentan-2-amine.
Chemical Property Profile of 1,1-Dimethyl-N-tert-octylpropargylamine
Property Insights of 1,1-Dimethyl-N-tert-octylpropargylamine
The XLogP value of 3.2026 indicates that 1,1-Dimethyl-N-tert-octylpropargylamine is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 12.03 Ų, 1,1-Dimethyl-N-tert-octylpropargylamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,1-Dimethyl-N-tert-octylpropargylamine 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
Frequently Asked Questions
What is the CAS number of 1,1-Dimethyl-N-tert-octylpropargylamine?
The CAS number of 1,1-Dimethyl-N-tert-octylpropargylamine is 263254-99-5.
What is the molecular formula of 1,1-Dimethyl-N-tert-octylpropargylamine?
The molecular formula of 1,1-Dimethyl-N-tert-octylpropargylamine is C13H25N.
What is the molecular weight of 1,1-Dimethyl-N-tert-octylpropargylamine?
The molecular weight of 1,1-Dimethyl-N-tert-octylpropargylamine is 195.20 g/mol.
Where can I buy 1,1-Dimethyl-N-tert-octylpropargylamine?
You can request a quote for 1,1-Dimethyl-N-tert-octylpropargylamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,1-Dimethyl-N-tert-octylpropargylamine?
Yes, KEHONG BIO provides custom synthesis services for 1,1-Dimethyl-N-tert-octylpropargylamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.