5,N,N-三甲基色胺
TL;DR: 5,N,N-三甲基色胺 (CAS 22120-39-4) is a chemical compound with molecular formula C13H18N2 and molecular weight 202.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5,N,N-三甲基色胺
N,N-dimethyl-2-(5-methyl-1H-indol-3-yl)ethanamine
Also Known As: N,N-Dimethyl-5-methyltryptamine, 3-Hydroxy-2-piperidone, 5-METHYL-N,N-DIMETHYLTRYPTAMINE, N,N-5-Trimethyl-1H-indole-3-ethanamine, 1H-Indole-3-ethanamine, N,N,5-trimethyl-
| Molecular Formula | C13H18N2 |
|---|---|
| Molecular Weight | 202.15 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 19.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.147 |
| Heavy Atoms | 15 |
| Complexity | 203.0 |
Chemical Identifiers
| CAS Number | 22120-39-4 |
|---|---|
| SMILES | CC1=CC2=C(C=C1)NC=C2CCN(C)C |
| InChIKey | NCGJLYBZSJSCIC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5,N,N-三甲基色胺 (CAS 22120-39-4), with molecular formula C13H18N2 and molecular weight 202.15 g/mol. IUPAC: N,N-dimethyl-2-(5-methyl-1H-indol-3-yl)ethanamine.
Chemical Property Profile of 5,N,N-三甲基色胺
Property Insights of 5,N,N-三甲基色胺
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5,N,N-三甲基色胺. With a topological polar surface area (TPSA) of 19.0 Ų, 5,N,N-三甲基色胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5,N,N-三甲基色胺 has 1 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 5,N,N-三甲基色胺?
The CAS number of 5,N,N-三甲基色胺 is 22120-39-4.
What is the molecular formula of 5,N,N-三甲基色胺?
The molecular formula of 5,N,N-三甲基色胺 is C13H18N2.
What is the molecular weight of 5,N,N-三甲基色胺?
The molecular weight of 5,N,N-三甲基色胺 is 202.15 g/mol.
Where can I buy 5,N,N-三甲基色胺?
You can request a quote for 5,N,N-三甲基色胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5,N,N-三甲基色胺?
Yes, KEHONG BIO provides custom synthesis services for 5,N,N-三甲基色胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.