Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester
TL;DR: Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester (CAS 548-49-2) is a chemical compound with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
ethyl N-(3-methyl-2-pyridinyl)carbamate
Also Known As: 4-Methyl-2-pyridylurethane, 3-Methyl-2-pyridyl-urethan, 3-Methyl-2-pyridinecarbamic acid ethyl ester, ethyl N-(3-methylpyridin-2-yl)carbamate, ethyl(3-methylpyridin-2-yl)carbamate
| Molecular Formula | C9H12N2O2 |
|---|---|
| Molecular Weight | 180.09 g/mol |
| LogP | 1.5 |
| Topological Polar Surface Area | 51.2 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 180.08987 |
| Heavy Atoms | 13 |
| Complexity | 173.0 |
Chemical Identifiers
| CAS Number | 548-49-2 |
|---|---|
| SMILES | CCOC(=O)NC1=C(C=CC=N1)C |
| InChIKey | QRKWCZJKNOGGIQ-UHFFFAOYSA-N |
Product Overview
Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester (CAS 548-49-2), with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol. IUPAC: ethyl N-(3-methyl-2-pyridinyl)carbamate.
Chemical Property Profile of Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester
Property Insights of Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester
The XLogP value of 1.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester. With a topological polar surface area (TPSA) of 51.2 Ų, Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester has 1 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 Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester?
The CAS number of Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester is 548-49-2.
What is the molecular formula of Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester?
The molecular formula of Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester is C9H12N2O2.
What is the molecular weight of Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester?
The molecular weight of Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester is 180.09 g/mol.
Where can I buy Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester?
You can request a quote for Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester?
Yes, KEHONG BIO provides custom synthesis services for Carbamic acid, (3-methyl-2-pyridinyl)-, ethyl ester and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.