3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid
TL;DR: 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid (CAS 452346-64-4) is a chemical compound with molecular formula C16H27NO3 and molecular weight 281.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(cyclohexylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid
Also Known As: 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid, BAS 01417472, BIM-0015750.P001, 3-(cyclohexylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid, 3-(Cyclohexylcarbamoyl)-1,2,2-trimethylcyclopentanecarboxylic acid
| Molecular Formula | C16H27NO3 |
|---|---|
| Molecular Weight | 281.20 g/mol |
| LogP | 2.9624 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 281.1991 |
| Heavy Atoms | 20 |
| Complexity | 398.52615 |
Chemical Identifiers
| CAS Number | 452346-64-4 |
|---|---|
| SMILES | CC1(C(CCC1(C)C(=O)O)C(=O)NC2CCCCC2)C |
Product Overview
3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid (CAS 452346-64-4), with molecular formula C16H27NO3 and molecular weight 281.20 g/mol. IUPAC: 3-(cyclohexylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid.
Chemical Property Profile of 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid
Property Insights of 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid
The XLogP value of 2.9624 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid. Following Lipinski's Rule of Five, 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid 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 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid?
The CAS number of 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid is 452346-64-4.
What is the molecular formula of 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid?
The molecular formula of 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid is C16H27NO3.
What is the molecular weight of 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid?
The molecular weight of 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid is 281.20 g/mol.
Where can I buy 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid?
You can request a quote for 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-Cyclohexylcarbamoyl-1,2,2-trimethyl-cyclopentanecarboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.