3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid
TL;DR: 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid (CAS 627844-39-7) is a chemical compound with molecular formula C12H21NO3 and molecular weight 227.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-(ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid
Also Known As: Cyclohexanone,3-(benzoyloxy), CHEMBRDG-BB9071809, 3-[(ETHYLAMINO)CARBONYL]-1,2,2-TRIMETHYLCYCLOPENTANECARBOXYLIC ACID, 3-(ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid, CHEMBRDG-BB 9071809
| Molecular Formula | C12H21NO3 |
|---|---|
| Molecular Weight | 227.15 g/mol |
| LogP | 1.6496 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 227.15215 |
| Heavy Atoms | 16 |
| Complexity | 311.38574 |
Chemical Identifiers
| CAS Number | 627844-39-7 |
|---|---|
| SMILES | CCNC(=O)C1CCC(C1(C)C)(C)C(=O)O |
Product Overview
3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid (CAS 627844-39-7), with molecular formula C12H21NO3 and molecular weight 227.15 g/mol. IUPAC: 3-(ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid.
Chemical Property Profile of 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid
Property Insights of 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid
The XLogP value of 1.6496 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid. Following Lipinski's Rule of Five, 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic 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-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid?
The CAS number of 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid is 627844-39-7.
What is the molecular formula of 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid?
The molecular formula of 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid is C12H21NO3.
What is the molecular weight of 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid?
The molecular weight of 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid is 227.15 g/mol.
Where can I buy 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid?
You can request a quote for 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 3-(Ethylcarbamoyl)-1,2,2-trimethylcyclopentane-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.