![6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid structure](/static/products/545/545364-35-0.png)
6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
TL;DR: 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid (CAS 545364-35-0) is a chemical compound with molecular formula C12H19NO3 and molecular weight 225.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(2-methylpropylcarbamoyl)cyclohex-3-ene-1-carboxylic acid
Also Known As: 6-(2-methylpropylcarbamoyl)cyclohex-3-ene-1-carboxylic Acid, 6-[(2-methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid, 6-[(ISOBUTYLAMINO)CARBONYL]-3-CYCLOHEXENE-1-CARBOXYLIC ACID
| Molecular Formula | C12H19NO3 |
|---|---|
| Molecular Weight | 225.14 g/mol |
| LogP | 1.4256 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 225.13649 |
| Heavy Atoms | 16 |
| Complexity | 296.639 |
Chemical Identifiers
| CAS Number | 545364-35-0 |
|---|---|
| SMILES | CC(C)CNC(=O)C1CC=CCC1C(=O)O |
Product Overview
6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid (CAS 545364-35-0), with molecular formula C12H19NO3 and molecular weight 225.14 g/mol. IUPAC: 6-(2-methylpropylcarbamoyl)cyclohex-3-ene-1-carboxylic acid.
Chemical Property Profile of 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
Property Insights of 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid
The XLogP value of 1.4256 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid. Following Lipinski's Rule of Five, 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-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 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid?
The CAS number of 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid is 545364-35-0.
What is the molecular formula of 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid?
The molecular formula of 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid is C12H19NO3.
What is the molecular weight of 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid?
The molecular weight of 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid is 225.14 g/mol.
Where can I buy 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid?
You can request a quote for 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-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 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 6-[(2-Methylpropyl)carbamoyl]cyclohex-3-ene-1-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.