2-Benzylamino-3-pyridinecarboxamide
TL;DR: 2-Benzylamino-3-pyridinecarboxamide (CAS 57311-16-7) is a chemical compound with molecular formula C13H13N3O and molecular weight 227.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(benzylamino)pyridine-3-carboxamide
Also Known As: 2-(Benzylamino)nicotinamide, 2-(benzylamino)pyridine-3-carboxamide, 2-Benzylamino-3-pyridinecarboxamide, 2-(Benzylamino)nicotinamide #, 3-Pyridinecarboxamide, 2-[(phenylmethyl)amino]-
| Molecular Formula | C13H13N3O |
|---|---|
| Molecular Weight | 227.11 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 68.0 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 4 |
| Exact Mass | 227.10587 |
| Heavy Atoms | 17 |
| Complexity | 251.0 |
Chemical Identifiers
| CAS Number | 57311-16-7 |
|---|---|
| SMILES | C1=CC=C(C=C1)CNC2=C(C=CC=N2)C(=O)N |
| InChIKey | AZOXEVJCATWNIM-UHFFFAOYSA-N |
Product Overview
2-Benzylamino-3-pyridinecarboxamide (CAS 57311-16-7), with molecular formula C13H13N3O and molecular weight 227.11 g/mol. IUPAC: 2-(benzylamino)pyridine-3-carboxamide.
Chemical Property Profile of 2-Benzylamino-3-pyridinecarboxamide
Property Insights of 2-Benzylamino-3-pyridinecarboxamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Benzylamino-3-pyridinecarboxamide. The TPSA of 68.0 Ų falls within the moderate polarity range, balancing permeability and solubility for 2-Benzylamino-3-pyridinecarboxamide. Following Lipinski's Rule of Five, 2-Benzylamino-3-pyridinecarboxamide has 2 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-Benzylamino-3-pyridinecarboxamide?
The CAS number of 2-Benzylamino-3-pyridinecarboxamide is 57311-16-7.
What is the molecular formula of 2-Benzylamino-3-pyridinecarboxamide?
The molecular formula of 2-Benzylamino-3-pyridinecarboxamide is C13H13N3O.
What is the molecular weight of 2-Benzylamino-3-pyridinecarboxamide?
The molecular weight of 2-Benzylamino-3-pyridinecarboxamide is 227.11 g/mol.
Where can I buy 2-Benzylamino-3-pyridinecarboxamide?
You can request a quote for 2-Benzylamino-3-pyridinecarboxamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Benzylamino-3-pyridinecarboxamide?
Yes, KEHONG BIO provides custom synthesis services for 2-Benzylamino-3-pyridinecarboxamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.