3-Methyl-2-(methylamino)pentanoic acid hydrochloride
TL;DR: 3-Methyl-2-(methylamino)pentanoic acid hydrochloride (CAS 4125-98-8) is a chemical compound with molecular formula C7H16ClNO2 and molecular weight 181.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-methyl-2-(methylamino)pentanoic acid;hydrochloride
Also Known As: N-Me-D-Ile-OH.HCl, N-Me-Ile-OH, N-Me-Ile-OH.HCl, 3-methyl-2-(methylamino)pentanoic acid hydrochloride, N-Methyl-L-isoleucine hydrochloride
| Molecular Formula | C7H16ClNO2 |
|---|---|
| Molecular Weight | 181.09 g/mol |
| LogP | 1.1269 |
| Topological Polar Surface Area | 49.33 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 181.08696 |
| Heavy Atoms | 11 |
| Complexity | 119.0082 |
Chemical Identifiers
| CAS Number | 4125-98-8 |
|---|---|
| SMILES | CCC(C)C(C(=O)O)NC.Cl |
Product Overview
3-Methyl-2-(methylamino)pentanoic acid hydrochloride (CAS 4125-98-8), with molecular formula C7H16ClNO2 and molecular weight 181.09 g/mol. IUPAC: 3-methyl-2-(methylamino)pentanoic acid;hydrochloride.
Chemical Property Profile of 3-Methyl-2-(methylamino)pentanoic acid hydrochloride
Property Insights of 3-Methyl-2-(methylamino)pentanoic acid hydrochloride
The XLogP value of 1.1269 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Methyl-2-(methylamino)pentanoic acid hydrochloride. With a topological polar surface area (TPSA) of 49.33 Ų, 3-Methyl-2-(methylamino)pentanoic acid hydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Methyl-2-(methylamino)pentanoic acid hydrochloride 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-Methyl-2-(methylamino)pentanoic acid hydrochloride?
The CAS number of 3-Methyl-2-(methylamino)pentanoic acid hydrochloride is 4125-98-8.
What is the molecular formula of 3-Methyl-2-(methylamino)pentanoic acid hydrochloride?
The molecular formula of 3-Methyl-2-(methylamino)pentanoic acid hydrochloride is C7H16ClNO2.
What is the molecular weight of 3-Methyl-2-(methylamino)pentanoic acid hydrochloride?
The molecular weight of 3-Methyl-2-(methylamino)pentanoic acid hydrochloride is 181.09 g/mol.
Where can I buy 3-Methyl-2-(methylamino)pentanoic acid hydrochloride?
You can request a quote for 3-Methyl-2-(methylamino)pentanoic acid hydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Methyl-2-(methylamino)pentanoic acid hydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 3-Methyl-2-(methylamino)pentanoic acid hydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.