3-(Diallylaminomethyl)-indole
TL;DR: 3-(Diallylaminomethyl)-indole (CAS 150462-35-4) is a chemical compound with molecular formula C15H18N2 and molecular weight 226.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1H-indol-3-ylmethyl)-N-prop-2-enylprop-2-en-1-amine
Also Known As: 3-(diallylaminomethyl)-indole, ChemDiv2_003826, AURORA 16551, N,N-diallyl-N-(1H-indol-3-ylmethyl)amine, N-((1H-indol-3-yl)methyl)-N-allylprop-2-en-1-amine
| Molecular Formula | C15H18N2 |
|---|---|
| Molecular Weight | 226.15 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 19.0 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 226.147 |
| Heavy Atoms | 17 |
| Complexity | 252.0 |
Chemical Identifiers
| CAS Number | 150462-35-4 |
|---|---|
| SMILES | C=CCN(CC=C)CC1=CNC2=CC=CC=C21 |
| InChIKey | QCAGDBAHYRSLLN-UHFFFAOYSA-N |
Product Overview
3-(Diallylaminomethyl)-indole (CAS 150462-35-4), with molecular formula C15H18N2 and molecular weight 226.15 g/mol. IUPAC: N-(1H-indol-3-ylmethyl)-N-prop-2-enylprop-2-en-1-amine.
Chemical Property Profile of 3-(Diallylaminomethyl)-indole
Property Insights of 3-(Diallylaminomethyl)-indole
The XLogP value of 3.1 indicates that 3-(Diallylaminomethyl)-indole is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 19.0 Ų, 3-(Diallylaminomethyl)-indole exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Diallylaminomethyl)-indole 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 3-(Diallylaminomethyl)-indole?
The CAS number of 3-(Diallylaminomethyl)-indole is 150462-35-4.
What is the molecular formula of 3-(Diallylaminomethyl)-indole?
The molecular formula of 3-(Diallylaminomethyl)-indole is C15H18N2.
What is the molecular weight of 3-(Diallylaminomethyl)-indole?
The molecular weight of 3-(Diallylaminomethyl)-indole is 226.15 g/mol.
Where can I buy 3-(Diallylaminomethyl)-indole?
You can request a quote for 3-(Diallylaminomethyl)-indole directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Diallylaminomethyl)-indole?
Yes, KEHONG BIO provides custom synthesis services for 3-(Diallylaminomethyl)-indole and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.