3-(Ethyl(methyl)amino)propanenitrile
TL;DR: 3-(Ethyl(methyl)amino)propanenitrile (CAS 55619-46-0) is a chemical compound with molecular formula C6H12N2 and molecular weight 112.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-[ethyl(methyl)amino]propanenitrile
Also Known As: 3-[Ethyl(methyl)amino]propanenitrile, 3-(Ethyl(Methyl)amino)propanenitrile, Propanenitrile, 3-(ethylmethylamino)-, 3-(Ethylmethylamino)propanenitrile, (3-METHOXYBUTYL)AMINE HYDROCHLORIDE
| Molecular Formula | C6H12N2 |
|---|---|
| Molecular Weight | 112.10 g/mol |
| LogP | 0.3 |
| Topological Polar Surface Area | 27.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 112.10005 |
| Heavy Atoms | 8 |
| Complexity | 89.0 |
Chemical Identifiers
| CAS Number | 55619-46-0 |
|---|---|
| SMILES | CCN(C)CCC#N |
| InChIKey | XDZSWBPZWOQXCQ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Ethyl(methyl)amino)propanenitrile (CAS 55619-46-0), with molecular formula C6H12N2 and molecular weight 112.10 g/mol. IUPAC: 3-[ethyl(methyl)amino]propanenitrile.
Chemical Property Profile of 3-(Ethyl(methyl)amino)propanenitrile
Property Insights of 3-(Ethyl(methyl)amino)propanenitrile
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Ethyl(methyl)amino)propanenitrile. With a topological polar surface area (TPSA) of 27.0 Ų, 3-(Ethyl(methyl)amino)propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Ethyl(methyl)amino)propanenitrile has 0 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 3-(Ethyl(methyl)amino)propanenitrile?
The CAS number of 3-(Ethyl(methyl)amino)propanenitrile is 55619-46-0.
What is the molecular formula of 3-(Ethyl(methyl)amino)propanenitrile?
The molecular formula of 3-(Ethyl(methyl)amino)propanenitrile is C6H12N2.
What is the molecular weight of 3-(Ethyl(methyl)amino)propanenitrile?
The molecular weight of 3-(Ethyl(methyl)amino)propanenitrile is 112.10 g/mol.
Where can I buy 3-(Ethyl(methyl)amino)propanenitrile?
You can request a quote for 3-(Ethyl(methyl)amino)propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Ethyl(methyl)amino)propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-(Ethyl(methyl)amino)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.