1,2,3,4-Tetrahydroisoquinoline-2-propionamide
TL;DR: 1,2,3,4-Tetrahydroisoquinoline-2-propionamide (CAS 35729-62-5) is a chemical compound with molecular formula C12H16N2O and molecular weight 204.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(3,4-dihydro-1H-isoquinolin-2-yl)propanamide
Also Known As: 1,2,3,4-Tetrahydroisoquinoline-2-propionamide, 3-(3,4-dihydro-1H-isoquinolin-2-yl)-propionamide, 3-(3,4-dihydroisoquinolin-2(1h)-yl)propanamide, 3-(3,4-dihydro-1H-isoquinolin-2-yl)propanamide, 3-(3,4-Dihydro-2(1H)-isoquinolinyl)propanamide #
| Molecular Formula | C12H16N2O |
|---|---|
| Molecular Weight | 204.13 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 46.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 204.12627 |
| Heavy Atoms | 15 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 35729-62-5 |
|---|---|
| SMILES | C1CN(CC2=CC=CC=C21)CCC(=O)N |
| InChIKey | FHIGOVYFZMOEBK-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1,2,3,4-Tetrahydroisoquinoline-2-propionamide (CAS 35729-62-5), with molecular formula C12H16N2O and molecular weight 204.13 g/mol. IUPAC: 3-(3,4-dihydro-1H-isoquinolin-2-yl)propanamide.
Chemical Property Profile of 1,2,3,4-Tetrahydroisoquinoline-2-propionamide
Property Insights of 1,2,3,4-Tetrahydroisoquinoline-2-propionamide
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1,2,3,4-Tetrahydroisoquinoline-2-propionamide. With a topological polar surface area (TPSA) of 46.3 Ų, 1,2,3,4-Tetrahydroisoquinoline-2-propionamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,2,3,4-Tetrahydroisoquinoline-2-propionamide has 1 hydrogen bond donor(s) and 2 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 1,2,3,4-Tetrahydroisoquinoline-2-propionamide?
The CAS number of 1,2,3,4-Tetrahydroisoquinoline-2-propionamide is 35729-62-5.
What is the molecular formula of 1,2,3,4-Tetrahydroisoquinoline-2-propionamide?
The molecular formula of 1,2,3,4-Tetrahydroisoquinoline-2-propionamide is C12H16N2O.
What is the molecular weight of 1,2,3,4-Tetrahydroisoquinoline-2-propionamide?
The molecular weight of 1,2,3,4-Tetrahydroisoquinoline-2-propionamide is 204.13 g/mol.
Where can I buy 1,2,3,4-Tetrahydroisoquinoline-2-propionamide?
You can request a quote for 1,2,3,4-Tetrahydroisoquinoline-2-propionamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,2,3,4-Tetrahydroisoquinoline-2-propionamide?
Yes, KEHONG BIO provides custom synthesis services for 1,2,3,4-Tetrahydroisoquinoline-2-propionamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.