N1-Benzyl-N3-methyl-1,3-propanediamine
TL;DR: N1-Benzyl-N3-methyl-1,3-propanediamine (CAS 883531-77-9) is a chemical compound with molecular formula C11H18N2 and molecular weight 178.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-benzyl-N-methylpropane-1,3-diamine
Also Known As: N1-Benzyl-N3-methyl-1,3-propanediamine, benzyl[3-(methylamino)propyl]amine, N'-benzyl-N-methylpropane-1,3-diamine, N-benzyl-N'-methyl-propane-1,3-diamine, BB 0259478
| Molecular Formula | C11H18N2 |
|---|---|
| Molecular Weight | 178.15 g/mol |
| LogP | 1.3857 |
| Topological Polar Surface Area | 24.06 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 178.147 |
| Heavy Atoms | 13 |
| Complexity | 208.59009 |
Chemical Identifiers
| CAS Number | 883531-77-9 |
|---|---|
| SMILES | CNCCCNCC1=CC=CC=C1 |
Product Overview
N1-Benzyl-N3-methyl-1,3-propanediamine (CAS 883531-77-9), with molecular formula C11H18N2 and molecular weight 178.15 g/mol. IUPAC: N'-benzyl-N-methylpropane-1,3-diamine.
Chemical Property Profile of N1-Benzyl-N3-methyl-1,3-propanediamine
Property Insights of N1-Benzyl-N3-methyl-1,3-propanediamine
The XLogP value of 1.3857 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N1-Benzyl-N3-methyl-1,3-propanediamine. With a topological polar surface area (TPSA) of 24.06 Ų, N1-Benzyl-N3-methyl-1,3-propanediamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N1-Benzyl-N3-methyl-1,3-propanediamine has 2 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 N1-Benzyl-N3-methyl-1,3-propanediamine?
The CAS number of N1-Benzyl-N3-methyl-1,3-propanediamine is 883531-77-9.
What is the molecular formula of N1-Benzyl-N3-methyl-1,3-propanediamine?
The molecular formula of N1-Benzyl-N3-methyl-1,3-propanediamine is C11H18N2.
What is the molecular weight of N1-Benzyl-N3-methyl-1,3-propanediamine?
The molecular weight of N1-Benzyl-N3-methyl-1,3-propanediamine is 178.15 g/mol.
Where can I buy N1-Benzyl-N3-methyl-1,3-propanediamine?
You can request a quote for N1-Benzyl-N3-methyl-1,3-propanediamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N1-Benzyl-N3-methyl-1,3-propanediamine?
Yes, KEHONG BIO provides custom synthesis services for N1-Benzyl-N3-methyl-1,3-propanediamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.