Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate
TL;DR: Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate (CAS 201992-23-6) is a chemical compound with molecular formula C13H21NO2 and molecular weight 223.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
methyl N-(1-adamantylmethyl)carbamate
Also Known As: ChemDiv3_000029, methyl N-(1-adamantylmethyl)carbamate, methyl (adamantan-1-ylmethyl)carbamate, N-(adamantanylmethyl)methoxycarboxamide, IDI1_019347
| Molecular Formula | C13H21NO2 |
|---|---|
| Molecular Weight | 223.16 g/mol |
| LogP | 2.5588 |
| Topological Polar Surface Area | 38.33 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 223.15723 |
| Heavy Atoms | 16 |
| Complexity | 265.0235 |
Chemical Identifiers
| CAS Number | 201992-23-6 |
|---|---|
| SMILES | COC(=O)NCC12CC3CC(C1)CC(C3)C2 |
Product Overview
Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate (CAS 201992-23-6), with molecular formula C13H21NO2 and molecular weight 223.16 g/mol. IUPAC: methyl N-(1-adamantylmethyl)carbamate.
Chemical Property Profile of Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate
Property Insights of Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate
The XLogP value of 2.5588 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate. With a topological polar surface area (TPSA) of 38.33 Ų, Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate 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 Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate?
The CAS number of Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate is 201992-23-6.
What is the molecular formula of Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate?
The molecular formula of Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate is C13H21NO2.
What is the molecular weight of Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate?
The molecular weight of Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate is 223.16 g/mol.
Where can I buy Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate?
You can request a quote for Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate?
Yes, KEHONG BIO provides custom synthesis services for Methyl ((3r,5r,7r)-adamantan-1-ylmethyl)carbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.