Propan-2-yl pyridin-2-ylcarbamate
TL;DR: Propan-2-yl pyridin-2-ylcarbamate (CAS 31020-32-3) 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.
propan-2-yl N-pyridin-2-ylcarbamate
Also Known As: isopropyl pyridin-2-ylcarbamate, Propan-2-yl pyridin-2-ylcarbamate, propan-2-yl N-pyridin-2-ylcarbamate, [2]pyridyl-carbamic acid isopropyl ester, Carbamic acid,2-pyridinyl-, 1-methylethyl ester (9CI)
| Molecular Formula | C9H12N2O2 |
|---|---|
| Molecular Weight | 180.09 g/mol |
| LogP | 1.8 |
| 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 | 171.0 |
Chemical Identifiers
| CAS Number | 31020-32-3 |
|---|---|
| SMILES | CC(C)OC(=O)NC1=CC=CC=N1 |
| InChIKey | FPRYAYYONDOGNO-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Propan-2-yl pyridin-2-ylcarbamate (CAS 31020-32-3), with molecular formula C9H12N2O2 and molecular weight 180.09 g/mol. IUPAC: propan-2-yl N-pyridin-2-ylcarbamate.
Chemical Property Profile of Propan-2-yl pyridin-2-ylcarbamate
Property Insights of Propan-2-yl pyridin-2-ylcarbamate
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Propan-2-yl pyridin-2-ylcarbamate. With a topological polar surface area (TPSA) of 51.2 Ų, Propan-2-yl pyridin-2-ylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Propan-2-yl pyridin-2-ylcarbamate 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 Propan-2-yl pyridin-2-ylcarbamate?
The CAS number of Propan-2-yl pyridin-2-ylcarbamate is 31020-32-3.
What is the molecular formula of Propan-2-yl pyridin-2-ylcarbamate?
The molecular formula of Propan-2-yl pyridin-2-ylcarbamate is C9H12N2O2.
What is the molecular weight of Propan-2-yl pyridin-2-ylcarbamate?
The molecular weight of Propan-2-yl pyridin-2-ylcarbamate is 180.09 g/mol.
Where can I buy Propan-2-yl pyridin-2-ylcarbamate?
You can request a quote for Propan-2-yl pyridin-2-ylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Propan-2-yl pyridin-2-ylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for Propan-2-yl pyridin-2-ylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.