N-(4-isobutoxyphenyl)isonicotinamide
TL;DR: N-(4-isobutoxyphenyl)isonicotinamide (CAS 881091-58-3) is a chemical compound with molecular formula C16H18N2O2 and molecular weight 270.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-[4-(2-methylpropoxy)phenyl]pyridine-4-carboxamide
Also Known As: N-(4-isobutoxyphenyl)isonicotinamide, N-[4-(2-methylpropoxy)phenyl]pyridine-4-carboxamide, AN-329/43386098, N-[4-(2-methylpropoxy)phenyl]-4-pyridylcarboxamide
| Molecular Formula | C16H18N2O2 |
|---|---|
| Molecular Weight | 270.14 g/mol |
| LogP | 3.3687 |
| Topological Polar Surface Area | 51.22 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 270.13684 |
| Heavy Atoms | 20 |
| Complexity | 550.4494 |
Chemical Identifiers
| CAS Number | 881091-58-3 |
|---|---|
| SMILES | CC(C)COC1=CC=C(C=C1)NC(=O)C2=CC=NC=C2 |
Product Overview
N-(4-isobutoxyphenyl)isonicotinamide (CAS 881091-58-3), with molecular formula C16H18N2O2 and molecular weight 270.14 g/mol. IUPAC: N-[4-(2-methylpropoxy)phenyl]pyridine-4-carboxamide.
Chemical Property Profile of N-(4-isobutoxyphenyl)isonicotinamide
Property Insights of N-(4-isobutoxyphenyl)isonicotinamide
The XLogP value of 3.3687 indicates that N-(4-isobutoxyphenyl)isonicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 51.22 Ų, N-(4-isobutoxyphenyl)isonicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(4-isobutoxyphenyl)isonicotinamide 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 N-(4-isobutoxyphenyl)isonicotinamide?
The CAS number of N-(4-isobutoxyphenyl)isonicotinamide is 881091-58-3.
What is the molecular formula of N-(4-isobutoxyphenyl)isonicotinamide?
The molecular formula of N-(4-isobutoxyphenyl)isonicotinamide is C16H18N2O2.
What is the molecular weight of N-(4-isobutoxyphenyl)isonicotinamide?
The molecular weight of N-(4-isobutoxyphenyl)isonicotinamide is 270.14 g/mol.
Where can I buy N-(4-isobutoxyphenyl)isonicotinamide?
You can request a quote for N-(4-isobutoxyphenyl)isonicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(4-isobutoxyphenyl)isonicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-(4-isobutoxyphenyl)isonicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.