3-oxo-N-(3-pyridylmethyl)butanamide
TL;DR: 3-oxo-N-(3-pyridylmethyl)butanamide (CAS 200431-97-6) is a chemical compound with molecular formula C10H12N2O2 and molecular weight 192.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-oxo-N-(pyridin-3-ylmethyl)butanamide
Also Known As: N-(3-PyridYl-Methyl)-Acetoacetamide, 3-oxo-N-(3-pyridylmethyl)butanamide, 3-oxo-N-(pyridin-3-ylmethyl)butanamide
| Molecular Formula | C10H12N2O2 |
|---|---|
| Molecular Weight | 192.09 g/mol |
| LogP | -0.2 |
| Topological Polar Surface Area | 59.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 192.08987 |
| Heavy Atoms | 14 |
| Complexity | 216.0 |
Chemical Identifiers
| CAS Number | 200431-97-6 |
|---|---|
| SMILES | CC(=O)CC(=O)NCC1=CN=CC=C1 |
| InChIKey | GQLKEJMFAVXDKR-UHFFFAOYSA-N |
Product Overview
3-oxo-N-(3-pyridylmethyl)butanamide (CAS 200431-97-6), with molecular formula C10H12N2O2 and molecular weight 192.09 g/mol. IUPAC: 3-oxo-N-(pyridin-3-ylmethyl)butanamide.
Chemical Property Profile of 3-oxo-N-(3-pyridylmethyl)butanamide
Property Insights of 3-oxo-N-(3-pyridylmethyl)butanamide
The XLogP value of -0.2 indicates that 3-oxo-N-(3-pyridylmethyl)butanamide is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 59.1 Ų, 3-oxo-N-(3-pyridylmethyl)butanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-oxo-N-(3-pyridylmethyl)butanamide 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 3-oxo-N-(3-pyridylmethyl)butanamide?
The CAS number of 3-oxo-N-(3-pyridylmethyl)butanamide is 200431-97-6.
What is the molecular formula of 3-oxo-N-(3-pyridylmethyl)butanamide?
The molecular formula of 3-oxo-N-(3-pyridylmethyl)butanamide is C10H12N2O2.
What is the molecular weight of 3-oxo-N-(3-pyridylmethyl)butanamide?
The molecular weight of 3-oxo-N-(3-pyridylmethyl)butanamide is 192.09 g/mol.
Where can I buy 3-oxo-N-(3-pyridylmethyl)butanamide?
You can request a quote for 3-oxo-N-(3-pyridylmethyl)butanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-oxo-N-(3-pyridylmethyl)butanamide?
Yes, KEHONG BIO provides custom synthesis services for 3-oxo-N-(3-pyridylmethyl)butanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.