N~3~-(2-phenylethyl)-beta-alaninamide
TL;DR: N~3~-(2-phenylethyl)-beta-alaninamide (CAS 4091-84-3) is a chemical compound with molecular formula C11H16N2O and molecular weight 192.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(2-phenylethylamino)propanamide
Also Known As: 3-(phenethylamino)propanamide, N~3~-(2-phenylethyl)-beta-alaninamide, 3-(2-phenylethylamino)propanamide, N3-(2-phenylethyl)-b-alaninamide, N3-(2-Phenylethyl)-beta-alaninamide
| Molecular Formula | C11H16N2O |
|---|---|
| Molecular Weight | 192.13 g/mol |
| LogP | 0.6941 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 6 |
| Exact Mass | 192.12627 |
| Heavy Atoms | 14 |
| Complexity | 271.87582 |
Chemical Identifiers
| CAS Number | 4091-84-3 |
|---|---|
| SMILES | C1=CC=C(C=C1)CCNCCC(=O)N |
Product Overview
N~3~-(2-phenylethyl)-beta-alaninamide (CAS 4091-84-3), with molecular formula C11H16N2O and molecular weight 192.13 g/mol. IUPAC: 3-(2-phenylethylamino)propanamide.
Chemical Property Profile of N~3~-(2-phenylethyl)-beta-alaninamide
Property Insights of N~3~-(2-phenylethyl)-beta-alaninamide
The XLogP value of 0.6941 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N~3~-(2-phenylethyl)-beta-alaninamide. With a topological polar surface area (TPSA) of 55.12 Ų, N~3~-(2-phenylethyl)-beta-alaninamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N~3~-(2-phenylethyl)-beta-alaninamide has 2 hydrogen bond donor(s) and 2 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~3~-(2-phenylethyl)-beta-alaninamide?
The CAS number of N~3~-(2-phenylethyl)-beta-alaninamide is 4091-84-3.
What is the molecular formula of N~3~-(2-phenylethyl)-beta-alaninamide?
The molecular formula of N~3~-(2-phenylethyl)-beta-alaninamide is C11H16N2O.
What is the molecular weight of N~3~-(2-phenylethyl)-beta-alaninamide?
The molecular weight of N~3~-(2-phenylethyl)-beta-alaninamide is 192.13 g/mol.
Where can I buy N~3~-(2-phenylethyl)-beta-alaninamide?
You can request a quote for N~3~-(2-phenylethyl)-beta-alaninamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N~3~-(2-phenylethyl)-beta-alaninamide?
Yes, KEHONG BIO provides custom synthesis services for N~3~-(2-phenylethyl)-beta-alaninamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.