Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1)
TL;DR: Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1) (CAS 59994-21-7) is a chemical compound with molecular formula C10H13ClN2O2 and molecular weight 228.06656 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
N-(3-aminophenyl)-3-oxobutanamide;hydrochloride
Also Known As: Butanamide, N-(3-aminophenyl)-3-oxo-, monohydrochloride, N-(3-Aminophenyl)-3-oxobutyramide monohydrochloride, N-(3-aminophenyl)-3-oxobutanamide hydrochloride, Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1), n-(3-aminophenyl)-3-oxobutanamide hydrochloride(1:1)
Technical Specifications
| Molecular Formula | C10H13ClN2O2 |
| Molecular Weight | 228.06656 g/mol |
| XLogP | 1.61 |
| Topological Polar Surface Area (TPSA) | 72.2 Ų |
| Hydrogen Bond Donors | 3 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 228.06656 Da |
| Heavy Atoms | 15 |
| Complexity | 228.0 |
| SMILES | CC(=O)CC(=O)NC1=CC=CC(=C1)N.Cl |
| InChIKey | QIBSDOIXYFFEEV-UHFFFAOYSA-N |
Chemical Property Profile of Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1)
Property Insights of Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1)
The XLogP value of 1.61 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1). The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1). Following Lipinski's Rule of Five, Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1) has 3 hydrogen bond donor(s) and 3 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1)?
The CAS number of Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1) is 59994-21-7.
What is the molecular formula of Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1)?
The molecular formula of Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1) is C10H13ClN2O2.
What is the molecular weight of Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1)?
The molecular weight of Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1) is 228.06656 g/mol.
Where can I buy Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1)?
You can request a quote for Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1) directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1)?
Yes, CoreyChem provides custom synthesis services for Butanamide, N-(3-aminophenyl)-3-oxo-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.