N-benzylpropane-1,3-diamine
TL;DR: N-benzylpropane-1,3-diamine (CAS 13910-48-0) is a chemical compound with molecular formula C10H16N2 and molecular weight 164.13135 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N'-benzylpropane-1,3-diamine
Also Known As: N1-Benzylpropane-1,3-diamine, 3-(Benzylamino)propylamine, N-Benzylpropane-1,3-diamine, N-Benzyl-1,3-propanediamine, N'-benzylpropane-1,3-diamine
Application Areas
Top 5 of 9 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C10H16N2 |
| Molecular Weight | 164.13135 g/mol |
| XLogP | 0.7 |
| Topological Polar Surface Area (TPSA) | 38.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 164.13135 Da |
| Heavy Atoms | 12 |
| Complexity | 98.0 |
| SMILES | C1=CC=C(C=C1)CNCCCN |
| InChIKey | RFLHDXQRFPJPRR-UHFFFAOYSA-N |
Chemical Property Profile of N-benzylpropane-1,3-diamine
Property Insights of N-benzylpropane-1,3-diamine
The XLogP value of 0.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-benzylpropane-1,3-diamine. With a topological polar surface area (TPSA) of 38.1 Ų, N-benzylpropane-1,3-diamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-benzylpropane-1,3-diamine 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
What is the CAS number of N-benzylpropane-1,3-diamine?
The CAS number of N-benzylpropane-1,3-diamine is 13910-48-0.
What is the molecular formula of N-benzylpropane-1,3-diamine?
The molecular formula of N-benzylpropane-1,3-diamine is C10H16N2.
What is the molecular weight of N-benzylpropane-1,3-diamine?
The molecular weight of N-benzylpropane-1,3-diamine is 164.13135 g/mol.
Where can I buy N-benzylpropane-1,3-diamine?
You can request a quote for N-benzylpropane-1,3-diamine directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for N-benzylpropane-1,3-diamine?
Yes, CoreyChem provides custom synthesis services for N-benzylpropane-1,3-diamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.