3-(Pyridin-3-yl)aniline
TL;DR: 3-(Pyridin-3-yl)aniline (CAS 57976-57-5) is a chemical compound with molecular formula C11H10N2 and molecular weight 170.08 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-pyridin-3-ylaniline
Also Known As: 3-(pyridin-3-yl)benzenamine, 3-pyridin-3-ylaniline, 3-(PYRIDIN-3-YL)ANILINE, 3-(3-Pyridyl)aniline, 3-(3-Aminophenyl)pyridine
| Molecular Formula | C11H10N2 |
|---|---|
| Molecular Weight | 170.08 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 38.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 170.0844 |
| Heavy Atoms | 13 |
| Complexity | 158.0 |
Chemical Identifiers
| CAS Number | 57976-57-5 |
|---|---|
| SMILES | C1=CC(=CC(=C1)N)C2=CN=CC=C2 |
| InChIKey | YTJQJGKMRLQBJP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-(Pyridin-3-yl)aniline (CAS 57976-57-5), with molecular formula C11H10N2 and molecular weight 170.08 g/mol. IUPAC: 3-pyridin-3-ylaniline.
Chemical Property Profile of 3-(Pyridin-3-yl)aniline
Property Insights of 3-(Pyridin-3-yl)aniline
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(Pyridin-3-yl)aniline. With a topological polar surface area (TPSA) of 38.9 Ų, 3-(Pyridin-3-yl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(Pyridin-3-yl)aniline 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 3-(Pyridin-3-yl)aniline?
The CAS number of 3-(Pyridin-3-yl)aniline is 57976-57-5.
What is the molecular formula of 3-(Pyridin-3-yl)aniline?
The molecular formula of 3-(Pyridin-3-yl)aniline is C11H10N2.
What is the molecular weight of 3-(Pyridin-3-yl)aniline?
The molecular weight of 3-(Pyridin-3-yl)aniline is 170.08 g/mol.
Where can I buy 3-(Pyridin-3-yl)aniline?
You can request a quote for 3-(Pyridin-3-yl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(Pyridin-3-yl)aniline?
Yes, KEHONG BIO provides custom synthesis services for 3-(Pyridin-3-yl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.