1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)-
TL;DR: 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)- (CAS 55667-50-0) is a chemical compound with molecular formula C13H22N2 and molecular weight 206.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N,2-trimethyl-N'-(4-methylphenyl)propane-1,3-diamine
Also Known As: n'-n,n,2-trimethyl-1,3-propanediamine, N'- -N,N,2-trimethyl-1,3-propanediamine, 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)-, N-[3-(dimethylamino)-2-methylpropyl]-4-methylaniline, N -(4-Methylphenyl)-N,N,2-trimethyl-1,3-propanediamine
| Molecular Formula | C13H22N2 |
|---|---|
| Molecular Weight | 206.18 g/mol |
| LogP | 3.1 |
| Topological Polar Surface Area | 15.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 206.1783 |
| Heavy Atoms | 15 |
| Complexity | 160.0 |
Chemical Identifiers
| CAS Number | 55667-50-0 |
|---|---|
| SMILES | CC1=CC=C(C=C1)NCC(C)CN(C)C |
| InChIKey | PYBGYAXYLGTHOK-UHFFFAOYSA-N |
Product Overview
1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)- (CAS 55667-50-0), with molecular formula C13H22N2 and molecular weight 206.18 g/mol. IUPAC: N,N,2-trimethyl-N'-(4-methylphenyl)propane-1,3-diamine.
Chemical Property Profile of 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)-
Property Insights of 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)-
The XLogP value of 3.1 indicates that 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)- is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 15.3 Ų, 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)- 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 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)-?
The CAS number of 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)- is 55667-50-0.
What is the molecular formula of 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)-?
The molecular formula of 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)- is C13H22N2.
What is the molecular weight of 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)-?
The molecular weight of 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)- is 206.18 g/mol.
Where can I buy 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)-?
You can request a quote for 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)-?
Yes, KEHONG BIO provides custom synthesis services for 1,3-Propanediamine, N,N,2-trimethyl-N'-(4-methylphenyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.