2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile
TL;DR: 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile (CAS 331979-91-0) is a chemical compound with molecular formula C15H15N3 and molecular weight 237.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-amino-6-ethyl-5-methyl-4-phenylpyridine-3-carbonitrile
Also Known As: TimTec1_006371, 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile, BAS 00727633, 2-Amino-6-ethyl-5-methyl-4-phenyl-nicotinonitrile, 2-amino-6-ethyl-5-methyl-4-phenylpyridine-3-carbonitrile
| Molecular Formula | C15H15N3 |
|---|---|
| Molecular Weight | 237.13 g/mol |
| LogP | 3.0733 |
| Topological Polar Surface Area | 62.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 237.1266 |
| Heavy Atoms | 18 |
| Complexity | 609.1212 |
Chemical Identifiers
| CAS Number | 331979-91-0 |
|---|---|
| SMILES | CCC1=C(C(=C(C(=N1)N)C#N)C2=CC=CC=C2)C |
Product Overview
2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile (CAS 331979-91-0), with molecular formula C15H15N3 and molecular weight 237.13 g/mol. IUPAC: 2-amino-6-ethyl-5-methyl-4-phenylpyridine-3-carbonitrile.
Chemical Property Profile of 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile
Property Insights of 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile
The XLogP value of 3.0733 indicates that 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. The TPSA of 62.7 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile. Following Lipinski's Rule of Five, 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile 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 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile?
The CAS number of 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile is 331979-91-0.
What is the molecular formula of 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile?
The molecular formula of 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile is C15H15N3.
What is the molecular weight of 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile?
The molecular weight of 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile is 237.13 g/mol.
Where can I buy 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile?
You can request a quote for 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-Amino-6-ethyl-5-methyl-4-phenylnicotinonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.