2-(Methylamino)propanenitrile
TL;DR: 2-(Methylamino)propanenitrile (CAS 16752-54-8) 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.
2-(methylamino)propanenitrile
Also Known As: 2-(Methylamino)propanenitrile, Propanenitrile, 2-(methylamino)-, 2-(Methylamino)propionitrile, Tetraphosphorus decaoxide, (Methylamino)propionitrile
| Molecular Formula | C4H8N2 |
|---|---|
| Molecular Weight | 84.07 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 35.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 84.06875 |
| Heavy Atoms | 6 |
| Complexity | 68.0 |
Chemical Identifiers
| CAS Number | 16752-54-8 |
|---|---|
| SMILES | CC(C#N)NC |
| InChIKey | MTKGPLGETVCLCF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 13 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-(Methylamino)propanenitrile (CAS 16752-54-8), with molecular formula C4H8N2 and molecular weight 84.07 g/mol. IUPAC: 2-(methylamino)propanenitrile.
Chemical Property Profile of 2-(Methylamino)propanenitrile
Property Insights of 2-(Methylamino)propanenitrile
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Methylamino)propanenitrile. With a topological polar surface area (TPSA) of 35.8 Ų, 2-(Methylamino)propanenitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Methylamino)propanenitrile 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 2-(Methylamino)propanenitrile?
The CAS number of 2-(Methylamino)propanenitrile is 16752-54-8.
What is the molecular formula of 2-(Methylamino)propanenitrile?
The molecular formula of 2-(Methylamino)propanenitrile is C4H8N2.
What is the molecular weight of 2-(Methylamino)propanenitrile?
The molecular weight of 2-(Methylamino)propanenitrile is 84.07 g/mol.
Where can I buy 2-(Methylamino)propanenitrile?
You can request a quote for 2-(Methylamino)propanenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Methylamino)propanenitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(Methylamino)propanenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.