Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate
TL;DR: Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate (CAS 958952-66-4) is a chemical compound with molecular formula C14H21N3O3 and molecular weight 279.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate
Also Known As: methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate, (2S)-methyl 3-methyl-2-(3-(pyridin-2-ylmethyl)ureido)pentanoate
| Molecular Formula | C14H21N3O3 |
|---|---|
| Molecular Weight | 279.16 g/mol |
| LogP | 1.4685 |
| Topological Polar Surface Area | 80.32 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 6 |
| Exact Mass | 279.1583 |
| Heavy Atoms | 20 |
| Complexity | 436.55008 |
Chemical Identifiers
| CAS Number | 958952-66-4 |
|---|---|
| SMILES | CCC(C)C(C(=O)OC)NC(=O)NCC1=CC=CC=N1 |
Product Overview
Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate (CAS 958952-66-4), with molecular formula C14H21N3O3 and molecular weight 279.16 g/mol. IUPAC: methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate.
Chemical Property Profile of Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate
Property Insights of Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate
The XLogP value of 1.4685 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate. The TPSA of 80.32 Ų falls within the moderate polarity range, balancing permeability and solubility for Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate. Following Lipinski's Rule of Five, Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate has 2 hydrogen bond donor(s) and 4 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 Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate?
The CAS number of Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate is 958952-66-4.
What is the molecular formula of Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate?
The molecular formula of Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate is C14H21N3O3.
What is the molecular weight of Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate?
The molecular weight of Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate is 279.16 g/mol.
Where can I buy Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate?
You can request a quote for Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-methyl-2-(pyridin-2-ylmethylcarbamoylamino)pentanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.