N-butyl-2-phenylacetamide
TL;DR: N-butyl-2-phenylacetamide (CAS 42880-22-8) is a chemical compound with molecular formula C12H17NO and molecular weight 191.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-2-phenylacetamide
Also Known As: N-butyl-2-phenylacetamide, N-butyl-2-phenyl-acetamide, Benzeneacetamide, N-butyl-, N-n-butylphenylacetamide, N-Butylphenylacetamide
| Molecular Formula | C12H17NO |
|---|---|
| Molecular Weight | 191.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 5 |
| Exact Mass | 191.13101 |
| Heavy Atoms | 14 |
| Complexity | 162.0 |
Chemical Identifiers
| CAS Number | 42880-22-8 |
|---|---|
| SMILES | CCCCNC(=O)CC1=CC=CC=C1 |
| InChIKey | JQZKYZUXIWDPAD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 4 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-butyl-2-phenylacetamide (CAS 42880-22-8), with molecular formula C12H17NO and molecular weight 191.13 g/mol. IUPAC: N-butyl-2-phenylacetamide.
Chemical Property Profile of N-butyl-2-phenylacetamide
Property Insights of N-butyl-2-phenylacetamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-butyl-2-phenylacetamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-butyl-2-phenylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-butyl-2-phenylacetamide has 1 hydrogen bond donor(s) and 1 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-butyl-2-phenylacetamide?
The CAS number of N-butyl-2-phenylacetamide is 42880-22-8.
What is the molecular formula of N-butyl-2-phenylacetamide?
The molecular formula of N-butyl-2-phenylacetamide is C12H17NO.
What is the molecular weight of N-butyl-2-phenylacetamide?
The molecular weight of N-butyl-2-phenylacetamide is 191.13 g/mol.
Where can I buy N-butyl-2-phenylacetamide?
You can request a quote for N-butyl-2-phenylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-butyl-2-phenylacetamide?
Yes, KEHONG BIO provides custom synthesis services for N-butyl-2-phenylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.