6-Tert-butylnicotinamide
TL;DR: 6-Tert-butylnicotinamide (CAS 4138-22-1) is a chemical compound with molecular formula C10H14N2O and molecular weight 178.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-tert-butylpyridine-3-carboxamide
Also Known As: 6-tert-butylnicotinamide, 6-(tert-Butyl)nicotinamide, 6-tert-butylpyridine-3-carboxamide, 6-tert-butyl-nicotinamide, 6-t-butylpyridine-3-carboxamide
| Molecular Formula | C10H14N2O |
|---|---|
| Molecular Weight | 178.11 g/mol |
| LogP | 1.478 |
| Topological Polar Surface Area | 55.98 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 178.11061 |
| Heavy Atoms | 13 |
| Complexity | 308.69177 |
Chemical Identifiers
| CAS Number | 4138-22-1 |
|---|---|
| SMILES | CC(C)(C)C1=NC=C(C=C1)C(=O)N |
Product Overview
6-Tert-butylnicotinamide (CAS 4138-22-1), with molecular formula C10H14N2O and molecular weight 178.11 g/mol. IUPAC: 6-tert-butylpyridine-3-carboxamide.
Chemical Property Profile of 6-Tert-butylnicotinamide
Property Insights of 6-Tert-butylnicotinamide
The XLogP value of 1.478 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-Tert-butylnicotinamide. With a topological polar surface area (TPSA) of 55.98 Ų, 6-Tert-butylnicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-Tert-butylnicotinamide 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 6-Tert-butylnicotinamide?
The CAS number of 6-Tert-butylnicotinamide is 4138-22-1.
What is the molecular formula of 6-Tert-butylnicotinamide?
The molecular formula of 6-Tert-butylnicotinamide is C10H14N2O.
What is the molecular weight of 6-Tert-butylnicotinamide?
The molecular weight of 6-Tert-butylnicotinamide is 178.11 g/mol.
Where can I buy 6-Tert-butylnicotinamide?
You can request a quote for 6-Tert-butylnicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-Tert-butylnicotinamide?
Yes, KEHONG BIO provides custom synthesis services for 6-Tert-butylnicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.