N-(Adamantan-1-yl)prop-2-enimidic acid
TL;DR: N-(Adamantan-1-yl)prop-2-enimidic acid (CAS 53874-80-9) is a chemical compound with molecular formula C13H19NO and molecular weight 205.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(1-adamantyl)prop-2-enamide
Also Known As: N-(1-adamantyl)acrylamide, n-adamantylacrylamide, N-(1-adamantyl)prop-2-enamide, N-(ADAMANTAN-1-YL)PROP-2-ENAMIDE, Wizard Monomer(R) AD
| Molecular Formula | C13H19NO |
|---|---|
| Molecular Weight | 205.15 g/mol |
| LogP | 2.8 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 2 |
| Exact Mass | 205.14667 |
| Heavy Atoms | 15 |
| Complexity | 266.0 |
Chemical Identifiers
| CAS Number | 53874-80-9 |
|---|---|
| SMILES | C=CC(=O)NC12CC3CC(C1)CC(C3)C2 |
| InChIKey | PBTMWGMSOKDCRP-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(Adamantan-1-yl)prop-2-enimidic acid (CAS 53874-80-9), with molecular formula C13H19NO and molecular weight 205.15 g/mol. IUPAC: N-(1-adamantyl)prop-2-enamide.
Chemical Property Profile of N-(Adamantan-1-yl)prop-2-enimidic acid
Property Insights of N-(Adamantan-1-yl)prop-2-enimidic acid
The XLogP value of 2.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(Adamantan-1-yl)prop-2-enimidic acid. With a topological polar surface area (TPSA) of 29.1 Ų, N-(Adamantan-1-yl)prop-2-enimidic acid exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(Adamantan-1-yl)prop-2-enimidic acid has 1 hydrogen bond donor(s) and 1 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)prop-2-enimidic acid?
The CAS number of N-(Adamantan-1-yl)prop-2-enimidic acid is 53874-80-9.
What is the molecular formula of N-(Adamantan-1-yl)prop-2-enimidic acid?
The molecular formula of N-(Adamantan-1-yl)prop-2-enimidic acid is C13H19NO.
What is the molecular weight of N-(Adamantan-1-yl)prop-2-enimidic acid?
The molecular weight of N-(Adamantan-1-yl)prop-2-enimidic acid is 205.15 g/mol.
Where can I buy N-(Adamantan-1-yl)prop-2-enimidic acid?
You can request a quote for N-(Adamantan-1-yl)prop-2-enimidic acid 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)prop-2-enimidic acid?
Yes, KEHONG BIO provides custom synthesis services for N-(Adamantan-1-yl)prop-2-enimidic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.