N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride
TL;DR: N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride (CAS 65141-45-9) is a chemical compound with molecular formula C8H10ClN3O4 and molecular weight 247.04 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(pyridine-3-carbonylamino)ethyl nitrate;hydrochloride
Also Known As: EINECS 265-513-6, N-(2-(Nitrooxy)ethyl)nicotinamide HCl, N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride, N-[2- ethyl]nicotinamidemonohydrochloride, N-[2-(NITROOXY)ETHYL]NICOTINAMIDE MONOHYDROCHLORIDE
| Molecular Formula | C8H10ClN3O4 |
|---|---|
| Molecular Weight | 247.04 g/mol |
| LogP | 0.4415 |
| Topological Polar Surface Area | 94.36 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 5 |
| Rotatable Bonds | 5 |
| Exact Mass | 247.03598 |
| Heavy Atoms | 16 |
| Complexity | 346.39648 |
Chemical Identifiers
| CAS Number | 65141-45-9 |
|---|---|
| SMILES | C1=CC(=CN=C1)C(=O)NCCO[N+](=O)[O-].Cl |
Product Overview
N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride (CAS 65141-45-9), with molecular formula C8H10ClN3O4 and molecular weight 247.04 g/mol. IUPAC: 2-(pyridine-3-carbonylamino)ethyl nitrate;hydrochloride.
Chemical Property Profile of N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride
Property Insights of N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride
The XLogP value of 0.4415 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride. The TPSA of 94.36 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride. Following Lipinski's Rule of Five, N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride has 1 hydrogen bond donor(s) and 5 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-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride?
The CAS number of N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride is 65141-45-9.
What is the molecular formula of N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride?
The molecular formula of N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride is C8H10ClN3O4.
What is the molecular weight of N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride?
The molecular weight of N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride is 247.04 g/mol.
Where can I buy N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride?
You can request a quote for N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for N-(2-(Nitrooxy)ethyl)nicotinamide monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.