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Methyl 3-[(pyridin-2-yl)amino]propanoate
TL;DR: Methyl 3-[(pyridin-2-yl)amino]propanoate (CAS 55780-69-3) is a chemical compound with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl 3-(pyridin-2-ylamino)propanoate
Also Known As: methyl 3-(pyridin-2-ylamino)propanoate, methyl 3-[(pyridin-2-yl)amino]propanoate, METHYL3- PROPANOATE, IFLab1_004530, N-2-Pyridinyl-b-alanine methyl ester
| Molecular Formula | C9H12N2O2 |
|---|---|
| Molecular Weight | 180.09 g/mol |
| LogP | 1.0566 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 180.08987 |
| Heavy Atoms | 13 |
| Complexity | 261.57703 |
Chemical Identifiers
| CAS Number | 55780-69-3 |
|---|---|
| SMILES | COC(=O)CCNC1=CC=CC=N1 |
Product Overview
Methyl 3-[(pyridin-2-yl)amino]propanoate (CAS 55780-69-3), with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol. IUPAC: methyl 3-(pyridin-2-ylamino)propanoate.
Chemical Property Profile of Methyl 3-[(pyridin-2-yl)amino]propanoate
Property Insights of Methyl 3-[(pyridin-2-yl)amino]propanoate
The XLogP value of 1.0566 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl 3-[(pyridin-2-yl)amino]propanoate. With a topological polar surface area (TPSA) of 51.22 Ų, Methyl 3-[(pyridin-2-yl)amino]propanoate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl 3-[(pyridin-2-yl)amino]propanoate has 1 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-[(pyridin-2-yl)amino]propanoate?
The CAS number of Methyl 3-[(pyridin-2-yl)amino]propanoate is 55780-69-3.
What is the molecular formula of Methyl 3-[(pyridin-2-yl)amino]propanoate?
The molecular formula of Methyl 3-[(pyridin-2-yl)amino]propanoate is C9H12N2O2.
What is the molecular weight of Methyl 3-[(pyridin-2-yl)amino]propanoate?
The molecular weight of Methyl 3-[(pyridin-2-yl)amino]propanoate is 180.09 g/mol.
Where can I buy Methyl 3-[(pyridin-2-yl)amino]propanoate?
You can request a quote for Methyl 3-[(pyridin-2-yl)amino]propanoate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl 3-[(pyridin-2-yl)amino]propanoate?
Yes, KEHONG BIO provides custom synthesis services for Methyl 3-[(pyridin-2-yl)amino]propanoate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.