![2-[1-(Benzylamino)ethylidene]propanedinitrile structure](/static/products/192/19219-92-2.png)
2-[1-(Benzylamino)ethylidene]propanedinitrile
TL;DR: 2-[1-(Benzylamino)ethylidene]propanedinitrile (CAS 19219-92-2) is a chemical compound with molecular formula C12H11N3 and molecular weight 197.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-[1-(benzylamino)ethylidene]propanedinitrile
Also Known As: 2-[1-(benzylamino)ethylidene]propanedinitrile, 2-(1-benzylaminoethylidene)malononitrile, 2-(1-(benzylamino)ethylidene)malononitrile
| Molecular Formula | C12H11N3 |
|---|---|
| Molecular Weight | 197.10 g/mol |
| LogP | 2.09736 |
| Topological Polar Surface Area | 59.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 197.09529 |
| Heavy Atoms | 15 |
| Complexity | 416.1753 |
Chemical Identifiers
| CAS Number | 19219-92-2 |
|---|---|
| SMILES | CC(=C(C#N)C#N)NCC1=CC=CC=C1 |
Product Overview
2-[1-(Benzylamino)ethylidene]propanedinitrile (CAS 19219-92-2), with molecular formula C12H11N3 and molecular weight 197.10 g/mol. IUPAC: 2-[1-(benzylamino)ethylidene]propanedinitrile.
Chemical Property Profile of 2-[1-(Benzylamino)ethylidene]propanedinitrile
Property Insights of 2-[1-(Benzylamino)ethylidene]propanedinitrile
The XLogP value of 2.09736 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-[1-(Benzylamino)ethylidene]propanedinitrile. With a topological polar surface area (TPSA) of 59.61 Ų, 2-[1-(Benzylamino)ethylidene]propanedinitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-[1-(Benzylamino)ethylidene]propanedinitrile has 1 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-[1-(Benzylamino)ethylidene]propanedinitrile?
The CAS number of 2-[1-(Benzylamino)ethylidene]propanedinitrile is 19219-92-2.
What is the molecular formula of 2-[1-(Benzylamino)ethylidene]propanedinitrile?
The molecular formula of 2-[1-(Benzylamino)ethylidene]propanedinitrile is C12H11N3.
What is the molecular weight of 2-[1-(Benzylamino)ethylidene]propanedinitrile?
The molecular weight of 2-[1-(Benzylamino)ethylidene]propanedinitrile is 197.10 g/mol.
Where can I buy 2-[1-(Benzylamino)ethylidene]propanedinitrile?
You can request a quote for 2-[1-(Benzylamino)ethylidene]propanedinitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-[1-(Benzylamino)ethylidene]propanedinitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-[1-(Benzylamino)ethylidene]propanedinitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.