N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide
TL;DR: N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide (CAS 5845-47-6) is a chemical compound with molecular formula C18H27N3O2 and molecular weight 317.21 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-(2,3-dimethylcyclohexyl)-N-(pyridin-2-ylmethyl)butanediamide
Also Known As: N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide, N'-(2,3-dimethylcyclohexyl)-N-(pyridin-2-ylmethyl)butanediamide
| Molecular Formula | C18H27N3O2 |
|---|---|
| Molecular Weight | 317.21 g/mol |
| LogP | 2.4189 |
| Topological Polar Surface Area | 71.09 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 317.21033 |
| Heavy Atoms | 23 |
| Complexity | 518.2578 |
Chemical Identifiers
| CAS Number | 5845-47-6 |
|---|---|
| SMILES | CC1CCCC(C1C)NC(=O)CCC(=O)NCC2=CC=CC=N2 |
Product Overview
N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide (CAS 5845-47-6), with molecular formula C18H27N3O2 and molecular weight 317.21 g/mol. IUPAC: N'-(2,3-dimethylcyclohexyl)-N-(pyridin-2-ylmethyl)butanediamide.
Chemical Property Profile of N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide
Property Insights of N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide
The XLogP value of 2.4189 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide. The TPSA of 71.09 Ų falls within the moderate polarity range, balancing permeability and solubility for N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide. Following Lipinski's Rule of Five, N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide has 2 hydrogen bond donor(s) and 3 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-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide?
The CAS number of N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide is 5845-47-6.
What is the molecular formula of N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide?
The molecular formula of N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide is C18H27N3O2.
What is the molecular weight of N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide?
The molecular weight of N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide is 317.21 g/mol.
Where can I buy N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide?
You can request a quote for N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide?
Yes, KEHONG BIO provides custom synthesis services for N-(2,3-dimethylcyclohexyl)-N'-(pyridin-2-ylmethyl)butanediamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.