N-Adamantan-1-yl-2-chloro-nicotinamide
TL;DR: N-Adamantan-1-yl-2-chloro-nicotinamide (CAS 445017-10-7) is a chemical compound with molecular formula C16H19ClN2O and molecular weight 290.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantyl)-2-chloropyridine-3-carboxamide
Also Known As: N-Adamantan-1-yl-2-chloro-nicotinamide, N-(Adamantan-1-yl)-2-chloronicotinamide, 4-Fluoro-1-methoxy-2-nitrobenzene, N-(1-adamantyl)-2-chloropyridine-3-carboxamide, N-(1-adamantyl)-2-chloronicotinamide
| Molecular Formula | C16H19ClN2O |
|---|---|
| Molecular Weight | 290.12 g/mol |
| LogP | 3.4336 |
| Topological Polar Surface Area | 41.99 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 290.1186 |
| Heavy Atoms | 20 |
| Complexity | 521.8786 |
Chemical Identifiers
| CAS Number | 445017-10-7 |
|---|---|
| SMILES | C1C2CC3CC1CC(C2)(C3)NC(=O)C4=C(N=CC=C4)Cl |
Product Overview
N-Adamantan-1-yl-2-chloro-nicotinamide (CAS 445017-10-7), with molecular formula C16H19ClN2O and molecular weight 290.12 g/mol. IUPAC: N-(1-adamantyl)-2-chloropyridine-3-carboxamide.
Chemical Property Profile of N-Adamantan-1-yl-2-chloro-nicotinamide
Property Insights of N-Adamantan-1-yl-2-chloro-nicotinamide
The XLogP value of 3.4336 indicates that N-Adamantan-1-yl-2-chloro-nicotinamide is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 41.99 Ų, N-Adamantan-1-yl-2-chloro-nicotinamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Adamantan-1-yl-2-chloro-nicotinamide 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 N-Adamantan-1-yl-2-chloro-nicotinamide?
The CAS number of N-Adamantan-1-yl-2-chloro-nicotinamide is 445017-10-7.
What is the molecular formula of N-Adamantan-1-yl-2-chloro-nicotinamide?
The molecular formula of N-Adamantan-1-yl-2-chloro-nicotinamide is C16H19ClN2O.
What is the molecular weight of N-Adamantan-1-yl-2-chloro-nicotinamide?
The molecular weight of N-Adamantan-1-yl-2-chloro-nicotinamide is 290.12 g/mol.
Where can I buy N-Adamantan-1-yl-2-chloro-nicotinamide?
You can request a quote for N-Adamantan-1-yl-2-chloro-nicotinamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Adamantan-1-yl-2-chloro-nicotinamide?
Yes, KEHONG BIO provides custom synthesis services for N-Adamantan-1-yl-2-chloro-nicotinamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.