n-Butyl-2-(methylamino)benzamide
TL;DR: n-Butyl-2-(methylamino)benzamide (CAS 53693-72-4) is a chemical compound with molecular formula C12H18N2O and molecular weight 206.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-butyl-2-(methylamino)benzamide
Also Known As: n-Butyl-2-(methylamino)benzamide, 2-Methylamino-N-(n-butyl)-benzamid, Benzamide, N-butyl-2-(methylamino)-, n-Butyl-2-(methylamino)benzamide #, RefChem:363538
| Molecular Formula | C12H18N2O |
|---|---|
| Molecular Weight | 206.14 g/mol |
| LogP | 2.6 |
| Topological Polar Surface Area | 41.1 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 206.1419 |
| Heavy Atoms | 15 |
| Complexity | 194.0 |
Chemical Identifiers
| CAS Number | 53693-72-4 |
|---|---|
| SMILES | CCCCNC(=O)C1=CC=CC=C1NC |
| InChIKey | ZPUCFROBIBAQQV-UHFFFAOYSA-N |
Product Overview
n-Butyl-2-(methylamino)benzamide (CAS 53693-72-4), with molecular formula C12H18N2O and molecular weight 206.14 g/mol. IUPAC: N-butyl-2-(methylamino)benzamide.
Chemical Property Profile of n-Butyl-2-(methylamino)benzamide
Property Insights of n-Butyl-2-(methylamino)benzamide
The XLogP value of 2.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for n-Butyl-2-(methylamino)benzamide. With a topological polar surface area (TPSA) of 41.1 Ų, n-Butyl-2-(methylamino)benzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, n-Butyl-2-(methylamino)benzamide 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-Butyl-2-(methylamino)benzamide?
The CAS number of n-Butyl-2-(methylamino)benzamide is 53693-72-4.
What is the molecular formula of n-Butyl-2-(methylamino)benzamide?
The molecular formula of n-Butyl-2-(methylamino)benzamide is C12H18N2O.
What is the molecular weight of n-Butyl-2-(methylamino)benzamide?
The molecular weight of n-Butyl-2-(methylamino)benzamide is 206.14 g/mol.
Where can I buy n-Butyl-2-(methylamino)benzamide?
You can request a quote for n-Butyl-2-(methylamino)benzamide 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-(methylamino)benzamide?
Yes, KEHONG BIO provides custom synthesis services for n-Butyl-2-(methylamino)benzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.