2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide
TL;DR: 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide (CAS 39668-77-4) is a chemical compound with molecular formula C13H25NO and molecular weight 211.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,N,5-trimethyl-2-propan-2-ylcyclohexane-1-carboxamide
Also Known As: EINECS 254-577-0, 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide, N,N,5-trimethyl-2-propan-2-ylcyclohexane-1-carboxamide, N,N,5-Trimethyl-2-(propan-2-yl)cyclohexane-1-carboxamide, N,N,5-Trimethyl-2-(1-methylethyl)cyclohexanecarboxamide
| Molecular Formula | C13H25NO |
|---|---|
| Molecular Weight | 211.19 g/mol |
| LogP | 2.783 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 211.19362 |
| Heavy Atoms | 15 |
| Complexity | 222.57584 |
Chemical Identifiers
| CAS Number | 39668-77-4 |
|---|---|
| SMILES | CC1CCC(C(C1)C(=O)N(C)C)C(C)C |
Product Overview
2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide (CAS 39668-77-4), with molecular formula C13H25NO and molecular weight 211.19 g/mol. IUPAC: N,N,5-trimethyl-2-propan-2-ylcyclohexane-1-carboxamide.
Chemical Property Profile of 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide
Property Insights of 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide
The XLogP value of 2.783 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide. With a topological polar surface area (TPSA) of 20.31 Ų, 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide has 0 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 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide?
The CAS number of 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide is 39668-77-4.
What is the molecular formula of 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide?
The molecular formula of 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide is C13H25NO.
What is the molecular weight of 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide?
The molecular weight of 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide is 211.19 g/mol.
Where can I buy 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide?
You can request a quote for 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-(Isopropyl)-N,N,5-trimethylcyclohexanecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.