Propanenitrile, 3-(methylamino)-
TL;DR: Propanenitrile, 3-(methylamino)- (CAS 693-05-0) is a chemical compound with molecular formula C4H8N2 and molecular weight 84.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(methylamino)propanenitrile
Also Known As: 3-(Methylamino)propanenitrile, 3-Methylaminopropionitrile, 3-(Methylamino)propionitrile, Propanenitrile, 3-(methylamino)-, (2-Cyanoethyl)methyl amine
| Molecular Formula | C4H8N2 |
|---|---|
| Molecular Weight | 84.07 g/mol |
| LogP | -0.5 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 84.06875 |
| Heavy Atoms | 6 |
| Complexity | 59.0 |
Chemical Identifiers
| CAS Number | 693-05-0 |
|---|---|
| SMILES | CNCCC#N |
| InChIKey | UNIJBMUBHBAUET-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 19 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propanenitrile, 3-(methylamino)- (CAS 693-05-0), with molecular formula C4H8N2 and molecular weight 84.07 g/mol. IUPAC: 3-(methylamino)propanenitrile.
Chemical Property Profile of Propanenitrile, 3-(methylamino)-
Property Insights of Propanenitrile, 3-(methylamino)-
The XLogP value of -0.5 indicates that Propanenitrile, 3-(methylamino)- is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 35.8 Ų, Propanenitrile, 3-(methylamino)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propanenitrile, 3-(methylamino)- 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 Propanenitrile, 3-(methylamino)-?
The CAS number of Propanenitrile, 3-(methylamino)- is 693-05-0.
What is the molecular formula of Propanenitrile, 3-(methylamino)-?
The molecular formula of Propanenitrile, 3-(methylamino)- is C4H8N2.
What is the molecular weight of Propanenitrile, 3-(methylamino)-?
The molecular weight of Propanenitrile, 3-(methylamino)- is 84.07 g/mol.
Where can I buy Propanenitrile, 3-(methylamino)-?
You can request a quote for Propanenitrile, 3-(methylamino)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propanenitrile, 3-(methylamino)-?
Yes, KEHONG BIO provides custom synthesis services for Propanenitrile, 3-(methylamino)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.