N-isopentyl-4-methylbenzamide
TL;DR: N-isopentyl-4-methylbenzamide (CAS 349145-71-7) is a chemical compound with molecular formula C13H19NO and molecular weight 205.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-methyl-N-(3-methylbutyl)benzamide
Also Known As: N-isopentyl-4-methylbenzamide, 4-methyl-N-(3-methylbutyl)benzamide, Benzamide, 4-methyl-N-(3-methylbutyl)-, AN-652/14925647
| Molecular Formula | C13H19NO |
|---|---|
| Molecular Weight | 205.15 g/mol |
| LogP | 2.77092 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 205.14667 |
| Heavy Atoms | 15 |
| Complexity | 313.81277 |
Chemical Identifiers
| CAS Number | 349145-71-7 |
|---|---|
| SMILES | CC1=CC=C(C=C1)C(=O)NCCC(C)C |
Product Overview
N-isopentyl-4-methylbenzamide (CAS 349145-71-7), with molecular formula C13H19NO and molecular weight 205.15 g/mol. IUPAC: 4-methyl-N-(3-methylbutyl)benzamide.
Chemical Property Profile of N-isopentyl-4-methylbenzamide
Property Insights of N-isopentyl-4-methylbenzamide
The XLogP value of 2.77092 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-isopentyl-4-methylbenzamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-isopentyl-4-methylbenzamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-isopentyl-4-methylbenzamide 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-isopentyl-4-methylbenzamide?
The CAS number of N-isopentyl-4-methylbenzamide is 349145-71-7.
What is the molecular formula of N-isopentyl-4-methylbenzamide?
The molecular formula of N-isopentyl-4-methylbenzamide is C13H19NO.
What is the molecular weight of N-isopentyl-4-methylbenzamide?
The molecular weight of N-isopentyl-4-methylbenzamide is 205.15 g/mol.
Where can I buy N-isopentyl-4-methylbenzamide?
You can request a quote for N-isopentyl-4-methylbenzamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-isopentyl-4-methylbenzamide?
Yes, KEHONG BIO provides custom synthesis services for N-isopentyl-4-methylbenzamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.