1-Diethylamino-2-pentyne
TL;DR: 1-Diethylamino-2-pentyne (CAS 73117-10-9) is a chemical compound with molecular formula C9H17N and molecular weight 139.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N-diethylpent-2-yn-1-amine
Also Known As: 1-Diethylamino-2-pentyne, N,N-diethylpent-2-yn-1-amine, Diaethyl-pent-2-inyl-amin, 2-Pentyn-1-amine, N,N-diethyl-, diethyl(pent-2-yn-1-yl)amine
| Molecular Formula | C9H17N |
|---|---|
| Molecular Weight | 139.14 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 139.1361 |
| Heavy Atoms | 10 |
| Complexity | 122.0 |
Chemical Identifiers
| CAS Number | 73117-10-9 |
|---|---|
| SMILES | CCC#CCN(CC)CC |
| InChIKey | GLYRYDQBPLDITK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-Diethylamino-2-pentyne (CAS 73117-10-9), with molecular formula C9H17N and molecular weight 139.14 g/mol. IUPAC: N,N-diethylpent-2-yn-1-amine.
Chemical Property Profile of 1-Diethylamino-2-pentyne
Property Insights of 1-Diethylamino-2-pentyne
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Diethylamino-2-pentyne. With a topological polar surface area (TPSA) of 3.2 Ų, 1-Diethylamino-2-pentyne exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Diethylamino-2-pentyne 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 1-Diethylamino-2-pentyne?
The CAS number of 1-Diethylamino-2-pentyne is 73117-10-9.
What is the molecular formula of 1-Diethylamino-2-pentyne?
The molecular formula of 1-Diethylamino-2-pentyne is C9H17N.
What is the molecular weight of 1-Diethylamino-2-pentyne?
The molecular weight of 1-Diethylamino-2-pentyne is 139.14 g/mol.
Where can I buy 1-Diethylamino-2-pentyne?
You can request a quote for 1-Diethylamino-2-pentyne directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Diethylamino-2-pentyne?
Yes, KEHONG BIO provides custom synthesis services for 1-Diethylamino-2-pentyne and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.