2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate
TL;DR: 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate (CAS 50341-98-5) is a chemical compound with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate
Also Known As: 2-(dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate, 1,2,3,4-Tetrahydro-3-isoquinolinecarboxylic acid 2-(dimethylamino)ethyl ester, 2-dimethylaminoethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate, 3-ISOQUINOLINECARBOXYLIC ACID, 1,2,3,4-TETRAHYDRO-, 2-(DIMETHYLAMINO)ETHYL ESTER, 1,2,3,4-Tetrahydroisoquinoline-1-carboxylic acid 2-(dimethylamino)ethyl ester
| Molecular Formula | C14H20N2O2 |
|---|---|
| Molecular Weight | 248.15 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 41.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 5 |
| Exact Mass | 248.15248 |
| Heavy Atoms | 18 |
| Complexity | 281.0 |
Chemical Identifiers
| CAS Number | 50341-98-5 |
|---|---|
| SMILES | CN(C)CCOC(=O)C1C2=CC=CC=C2CCN1 |
| InChIKey | PMDPZQIYJZLBFB-UHFFFAOYSA-N |
Product Overview
2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate (CAS 50341-98-5), with molecular formula C14H20N2O2 and molecular weight 248.15 g/mol. IUPAC: 2-(dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate.
Chemical Property Profile of 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate
Property Insights of 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate. With a topological polar surface area (TPSA) of 41.6 Ų, 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate has 1 hydrogen bond donor(s) and 4 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 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate?
The CAS number of 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate is 50341-98-5.
What is the molecular formula of 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate?
The molecular formula of 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate is C14H20N2O2.
What is the molecular weight of 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate?
The molecular weight of 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate is 248.15 g/mol.
Where can I buy 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate?
You can request a quote for 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate?
Yes, KEHONG BIO provides custom synthesis services for 2-(Dimethylamino)ethyl 1,2,3,4-tetrahydroisoquinoline-1-carboxylate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.