1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid
TL;DR: 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid (CAS 3614-76-4) is a chemical compound with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-methyl-5-pyridin-3-ylpyrrole-2-carboxylic acid
Also Known As: 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid, 1-methyl-5-pyridin-3-ylpyrrole-2-carboxylic acid, 1-methyl-5-(pyridin-3-yl)pyrrole-2-carboxylic acid, 1-methyl-5-(3-pyridinyl)-1H-pyrrole-2-carboxylic acid, 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylicacid
| Molecular Formula | C11H10N2O2 |
|---|---|
| Molecular Weight | 202.07 g/mol |
| LogP | 1.7853 |
| Topological Polar Surface Area | 55.12 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 202.07423 |
| Heavy Atoms | 15 |
| Complexity | 488.54395 |
Chemical Identifiers
| CAS Number | 3614-76-4 |
|---|---|
| SMILES | CN1C(=CC=C1C(=O)O)C2=CN=CC=C2 |
Product Overview
1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid (CAS 3614-76-4), with molecular formula C11H10N2O2 and molecular weight 202.07 g/mol. IUPAC: 1-methyl-5-pyridin-3-ylpyrrole-2-carboxylic acid.
Chemical Property Profile of 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid
Property Insights of 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid
The XLogP value of 1.7853 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid. With a topological polar surface area (TPSA) of 55.12 Ų, 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid has 1 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 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid?
The CAS number of 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid is 3614-76-4.
What is the molecular formula of 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid?
The molecular formula of 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid is C11H10N2O2.
What is the molecular weight of 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid?
The molecular weight of 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid is 202.07 g/mol.
Where can I buy 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid?
You can request a quote for 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid?
Yes, KEHONG BIO provides custom synthesis services for 1-methyl-5-(pyridin-3-yl)-1H-pyrrole-2-carboxylic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.