N-(1-Methylpropylidene)methanamine
TL;DR: N-(1-Methylpropylidene)methanamine (CAS 57585-51-0) is a chemical compound with molecular formula C5H11N and molecular weight 85.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methylbutan-2-imine
Also Known As: N-methylbutan-2-imine, trimethylethylimine, N-Methylbutane-2-imine, (2E)-N-Methylbutan-2-imine, N-(1-Methylpropylidene)methanamine
| Molecular Formula | C5H11N |
|---|---|
| Molecular Weight | 85.09 g/mol |
| LogP | 0.6 |
| Topological Polar Surface Area | 12.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 1 |
| Exact Mass | 85.08915 |
| Heavy Atoms | 6 |
| Complexity | 55.0 |
Chemical Identifiers
| CAS Number | 57585-51-0 |
|---|---|
| SMILES | CCC(=NC)C |
| InChIKey | SPEFTWCKOFCJBY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 9 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(1-Methylpropylidene)methanamine (CAS 57585-51-0), with molecular formula C5H11N and molecular weight 85.09 g/mol. IUPAC: N-methylbutan-2-imine.
Chemical Property Profile of N-(1-Methylpropylidene)methanamine
Property Insights of N-(1-Methylpropylidene)methanamine
The XLogP value of 0.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1-Methylpropylidene)methanamine. With a topological polar surface area (TPSA) of 12.4 Ų, N-(1-Methylpropylidene)methanamine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1-Methylpropylidene)methanamine has 0 hydrogen bond donor(s) and 1 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 N-(1-Methylpropylidene)methanamine?
The CAS number of N-(1-Methylpropylidene)methanamine is 57585-51-0.
What is the molecular formula of N-(1-Methylpropylidene)methanamine?
The molecular formula of N-(1-Methylpropylidene)methanamine is C5H11N.
What is the molecular weight of N-(1-Methylpropylidene)methanamine?
The molecular weight of N-(1-Methylpropylidene)methanamine is 85.09 g/mol.
Where can I buy N-(1-Methylpropylidene)methanamine?
You can request a quote for N-(1-Methylpropylidene)methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1-Methylpropylidene)methanamine?
Yes, KEHONG BIO provides custom synthesis services for N-(1-Methylpropylidene)methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.