1-(1-Adamantyl)-2-(isopropylamino)ethanone
TL;DR: 1-(1-Adamantyl)-2-(isopropylamino)ethanone (CAS 487012-61-3) is a chemical compound with molecular formula C15H25NO and molecular weight 235.19 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(1-adamantyl)-2-(propan-2-ylamino)ethanone
Also Known As: 1-(1-Adamantyl)-2-(isopropylamino)ethanone, CHEMBRDG-BB5807100, CHEMBRDG-BB 5807100, 1-Adamantan-1-yl-2-isopropylamino-ethanone, 1-(1-adamantyl)-2-(propan-2-ylamino)ethanone
| Molecular Formula | C15H25NO |
|---|---|
| Molecular Weight | 235.19 g/mol |
| LogP | 2.9 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 235.19362 |
| Heavy Atoms | 17 |
| Complexity | 280.0 |
Chemical Identifiers
| CAS Number | 487012-61-3 |
|---|---|
| SMILES | CC(C)NCC(=O)C12CC3CC(C1)CC(C3)C2 |
| InChIKey | QAWMGAIRTARNEZ-UHFFFAOYSA-N |
Product Overview
1-(1-Adamantyl)-2-(isopropylamino)ethanone (CAS 487012-61-3), with molecular formula C15H25NO and molecular weight 235.19 g/mol. IUPAC: 1-(1-adamantyl)-2-(propan-2-ylamino)ethanone.
Chemical Property Profile of 1-(1-Adamantyl)-2-(isopropylamino)ethanone
Property Insights of 1-(1-Adamantyl)-2-(isopropylamino)ethanone
The XLogP value of 2.9 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(1-Adamantyl)-2-(isopropylamino)ethanone. With a topological polar surface area (TPSA) of 29.1 Ų, 1-(1-Adamantyl)-2-(isopropylamino)ethanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(1-Adamantyl)-2-(isopropylamino)ethanone 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 1-(1-Adamantyl)-2-(isopropylamino)ethanone?
The CAS number of 1-(1-Adamantyl)-2-(isopropylamino)ethanone is 487012-61-3.
What is the molecular formula of 1-(1-Adamantyl)-2-(isopropylamino)ethanone?
The molecular formula of 1-(1-Adamantyl)-2-(isopropylamino)ethanone is C15H25NO.
What is the molecular weight of 1-(1-Adamantyl)-2-(isopropylamino)ethanone?
The molecular weight of 1-(1-Adamantyl)-2-(isopropylamino)ethanone is 235.19 g/mol.
Where can I buy 1-(1-Adamantyl)-2-(isopropylamino)ethanone?
You can request a quote for 1-(1-Adamantyl)-2-(isopropylamino)ethanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(1-Adamantyl)-2-(isopropylamino)ethanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(1-Adamantyl)-2-(isopropylamino)ethanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.