N-ethyl-N-prop-2-ynylprop-2-yn-1-amine
TL;DR: N-ethyl-N-prop-2-ynylprop-2-yn-1-amine (CAS 13002-92-1) is a chemical compound with molecular formula C8H11N and molecular weight 121.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-ethyl-N-prop-2-ynylprop-2-yn-1-amine
Also Known As: ethyldiprop-2-ynylamine, N,N-Dipropargylethaneamine, ethylbis(prop-2-yn-1-yl)amine, ethyldi(prop-2-ynyl)amine, N,N-Di(2-propynyl)-N-ethylamine
| Molecular Formula | C8H11N |
|---|---|
| Molecular Weight | 121.09 g/mol |
| LogP | 0.9 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 121.08915 |
| Heavy Atoms | 9 |
| Complexity | 134.0 |
Chemical Identifiers
| CAS Number | 13002-92-1 |
|---|---|
| SMILES | CCN(CC#C)CC#C |
| InChIKey | RTIINCDOGUBJOP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-ethyl-N-prop-2-ynylprop-2-yn-1-amine (CAS 13002-92-1), with molecular formula C8H11N and molecular weight 121.09 g/mol. IUPAC: N-ethyl-N-prop-2-ynylprop-2-yn-1-amine.
Chemical Property Profile of N-ethyl-N-prop-2-ynylprop-2-yn-1-amine
Property Insights of N-ethyl-N-prop-2-ynylprop-2-yn-1-amine
The XLogP value of 0.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-ethyl-N-prop-2-ynylprop-2-yn-1-amine. With a topological polar surface area (TPSA) of 3.2 Ų, N-ethyl-N-prop-2-ynylprop-2-yn-1-amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-ethyl-N-prop-2-ynylprop-2-yn-1-amine has 0 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 N-ethyl-N-prop-2-ynylprop-2-yn-1-amine?
The CAS number of N-ethyl-N-prop-2-ynylprop-2-yn-1-amine is 13002-92-1.
What is the molecular formula of N-ethyl-N-prop-2-ynylprop-2-yn-1-amine?
The molecular formula of N-ethyl-N-prop-2-ynylprop-2-yn-1-amine is C8H11N.
What is the molecular weight of N-ethyl-N-prop-2-ynylprop-2-yn-1-amine?
The molecular weight of N-ethyl-N-prop-2-ynylprop-2-yn-1-amine is 121.09 g/mol.
Where can I buy N-ethyl-N-prop-2-ynylprop-2-yn-1-amine?
You can request a quote for N-ethyl-N-prop-2-ynylprop-2-yn-1-amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-ethyl-N-prop-2-ynylprop-2-yn-1-amine?
Yes, KEHONG BIO provides custom synthesis services for N-ethyl-N-prop-2-ynylprop-2-yn-1-amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.