2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate
TL;DR: 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate (CAS 431995-76-5) is a chemical compound with molecular formula C16H26N2O2 and molecular weight 278.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[2-[(dimethylamino)methyl]-3-methyl-6-propan-2-ylphenyl] N,N-dimethylcarbamate
Also Known As: AO-365/40892366, 2-[(dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate, 2-((dimethylamino)methyl)-6-isopropyl-3-methylphenyl dimethylcarbamate, 2-[(dimethylamino)methyl]-6-isopropyl-3-methylphenyl dimethylcarbamate, [2-(dimethylaminomethyl)-3-methyl-6-propan-2-ylphenyl] N,N-dimethylcarbamate
| Molecular Formula | C16H26N2O2 |
|---|---|
| Molecular Weight | 278.20 g/mol |
| LogP | 3.0 |
| Topological Polar Surface Area | 32.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 278.19943 |
| Heavy Atoms | 20 |
| Complexity | 316.0 |
Chemical Identifiers
| CAS Number | 431995-76-5 |
|---|---|
| SMILES | CC1=C(C(=C(C=C1)C(C)C)OC(=O)N(C)C)CN(C)C |
| InChIKey | DESIXSTWARSRIG-UHFFFAOYSA-N |
Product Overview
2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate (CAS 431995-76-5), with molecular formula C16H26N2O2 and molecular weight 278.20 g/mol. IUPAC: [2-[(dimethylamino)methyl]-3-methyl-6-propan-2-ylphenyl] N,N-dimethylcarbamate.
Chemical Property Profile of 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate
Property Insights of 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate
The XLogP value of 3.0 indicates that 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 32.8 Ų, 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate has 0 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 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate?
The CAS number of 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate is 431995-76-5.
What is the molecular formula of 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate?
The molecular formula of 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate is C16H26N2O2.
What is the molecular weight of 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate?
The molecular weight of 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate is 278.20 g/mol.
Where can I buy 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate?
You can request a quote for 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 2-[(Dimethylamino)methyl]-3-methyl-6-(propan-2-yl)phenyl dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.