N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine
TL;DR: N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine (CAS 880811-99-4) is a chemical compound with molecular formula C12H22N2S and molecular weight 226.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N',N'-diethyl-N-[(5-methylthiophen-2-yl)methyl]ethane-1,2-diamine
Also Known As: ASN 12418284, [2-(DIETHYLAMINO)ETHYL][(5-METHYLTHIOPHEN-2-YL)METHYL]AMINE, AB01267750-03, AN-465/42886672, N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine
| Molecular Formula | C12H22N2S |
|---|---|
| Molecular Weight | 226.15 g/mol |
| LogP | 2.48792 |
| Topological Polar Surface Area | 15.27 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 226.15038 |
| Heavy Atoms | 15 |
| Complexity | 266.34076 |
Chemical Identifiers
| CAS Number | 880811-99-4 |
|---|---|
| SMILES | CCN(CC)CCNCC1=CC=C(S1)C |
Product Overview
N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine (CAS 880811-99-4), with molecular formula C12H22N2S and molecular weight 226.15 g/mol. IUPAC: N',N'-diethyl-N-[(5-methylthiophen-2-yl)methyl]ethane-1,2-diamine.
Chemical Property Profile of N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine
Property Insights of N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine
The XLogP value of 2.48792 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine. With a topological polar surface area (TPSA) of 15.27 Ų, N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine has 1 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 N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine?
The CAS number of N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine is 880811-99-4.
What is the molecular formula of N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine?
The molecular formula of N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine is C12H22N2S.
What is the molecular weight of N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine?
The molecular weight of N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine is 226.15 g/mol.
Where can I buy N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine?
You can request a quote for N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine?
Yes, KEHONG BIO provides custom synthesis services for N-[2-(diethylamino)ethyl]-N-[(5-methyl-2-thienyl)methyl]amine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.