N-(cyanomethyl)nicotinamide
TL;DR: N-(cyanomethyl)nicotinamide (CAS 35970-19-5) is a chemical compound with molecular formula C8H7N3O and molecular weight 161.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(cyanomethyl)pyridine-3-carboxamide
Also Known As: N-(cyanomethyl)nicotinamide, N-(cyanomethyl)pyridine-3-carboxamide, 3-pyridinecarboxamide,n-(cyanomethyl)-, 3-Pyridinecarboxamide, N-(cyanomethyl)- (9CI)
| Molecular Formula | C8H7N3O |
|---|---|
| Molecular Weight | 161.06 g/mol |
| LogP | 0.33498 |
| Topological Polar Surface Area | 65.78 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 161.05891 |
| Heavy Atoms | 12 |
| Complexity | 301.82904 |
Chemical Identifiers
| CAS Number | 35970-19-5 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)NCC#N |
Product Overview
N-(cyanomethyl)nicotinamide (CAS 35970-19-5), with molecular formula C8H7N3O and molecular weight 161.06 g/mol. IUPAC: N-(cyanomethyl)pyridine-3-carboxamide.
Chemical Property Profile of N-(cyanomethyl)nicotinamide
Property Insights of N-(cyanomethyl)nicotinamide
The XLogP value of 0.33498 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(cyanomethyl)nicotinamide. The TPSA of 65.78 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(cyanomethyl)nicotinamide. Following Lipinski's Rule of Five, N-(cyanomethyl)nicotinamide has 1 hydrogen bond donor(s) and 3 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)nicotinamide?
The CAS number of N-(cyanomethyl)nicotinamide is 35970-19-5.
What is the molecular formula of N-(cyanomethyl)nicotinamide?
The molecular formula of N-(cyanomethyl)nicotinamide is C8H7N3O.
What is the molecular weight of N-(cyanomethyl)nicotinamide?
The molecular weight of N-(cyanomethyl)nicotinamide is 161.06 g/mol.
Where can I buy N-(cyanomethyl)nicotinamide?
You can request a quote for N-(cyanomethyl)nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(cyanomethyl)nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(cyanomethyl)nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.