3-Amino-3-(pyridin-2-yl)prop-2-enenitrile
TL;DR: 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile (CAS 55330-52-4) is a chemical compound with molecular formula C8H7N3 and molecular weight 145.06 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-amino-3-pyridin-2-ylprop-2-enenitrile
Also Known As: 3-AMINO-3-(PYRIDIN-2-YL)ACRYLONITRILE, 3-amino-3-(2-pyridinyl)acrylonitrile, 3-amino-3-pyridin-2-ylprop-2-enenitrile, 3-Amino-3-pyridin-ylacrylonitrile, 3-Amino-3-pyridin-2-ylacrylonitrile
| Molecular Formula | C8H7N3 |
|---|---|
| Molecular Weight | 145.06 g/mol |
| LogP | 0.1 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 1 |
| Exact Mass | 145.064 |
| Heavy Atoms | 11 |
| Complexity | 199.0 |
Chemical Identifiers
| CAS Number | 55330-52-4 |
|---|---|
| SMILES | C1=CC=NC(=C1)C(=CC#N)N |
| InChIKey | UUIKPAVVDPUTNH-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-Amino-3-(pyridin-2-yl)prop-2-enenitrile (CAS 55330-52-4), with molecular formula C8H7N3 and molecular weight 145.06 g/mol. IUPAC: 3-amino-3-pyridin-2-ylprop-2-enenitrile.
Chemical Property Profile of 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile
Property Insights of 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile
The XLogP value of 0.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile. Following Lipinski's Rule of Five, 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile has 1 hydrogen bond donor(s) and 3 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-Amino-3-(pyridin-2-yl)prop-2-enenitrile?
The CAS number of 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile is 55330-52-4.
What is the molecular formula of 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile?
The molecular formula of 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile is C8H7N3.
What is the molecular weight of 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile?
The molecular weight of 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile is 145.06 g/mol.
Where can I buy 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile?
You can request a quote for 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile?
Yes, KEHONG BIO provides custom synthesis services for 3-Amino-3-(pyridin-2-yl)prop-2-enenitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.