N-(cyanomethyl)pentanamide
TL;DR: N-(cyanomethyl)pentanamide (CAS 36801-39-5) is a chemical compound with molecular formula C7H12N2O and molecular weight 140.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyanomethyl)pentanamide
Also Known As: N-(cyanomethyl)pentanamide, (Pentanoylamino)acetonitrile, J2.029.909F
| Molecular Formula | C7H12N2O |
|---|---|
| Molecular Weight | 140.09 g/mol |
| LogP | 0.81638 |
| Topological Polar Surface Area | 52.89 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 140.09496 |
| Heavy Atoms | 10 |
| Complexity | 137.03175 |
Chemical Identifiers
| CAS Number | 36801-39-5 |
|---|---|
| SMILES | CCCCC(=O)NCC#N |
Product Overview
N-(cyanomethyl)pentanamide (CAS 36801-39-5), with molecular formula C7H12N2O and molecular weight 140.09 g/mol. IUPAC: N-(cyanomethyl)pentanamide.
Chemical Property Profile of N-(cyanomethyl)pentanamide
Property Insights of N-(cyanomethyl)pentanamide
The XLogP value of 0.81638 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(cyanomethyl)pentanamide. With a topological polar surface area (TPSA) of 52.89 Ų, N-(cyanomethyl)pentanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(cyanomethyl)pentanamide 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 N-(cyanomethyl)pentanamide?
The CAS number of N-(cyanomethyl)pentanamide is 36801-39-5.
What is the molecular formula of N-(cyanomethyl)pentanamide?
The molecular formula of N-(cyanomethyl)pentanamide is C7H12N2O.
What is the molecular weight of N-(cyanomethyl)pentanamide?
The molecular weight of N-(cyanomethyl)pentanamide is 140.09 g/mol.
Where can I buy N-(cyanomethyl)pentanamide?
You can request a quote for N-(cyanomethyl)pentanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(cyanomethyl)pentanamide?
Yes, KEHONG BIO provides custom synthesis services for N-(cyanomethyl)pentanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.