3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate
TL;DR: 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate (CAS 1067-69-2) is a chemical compound with molecular formula C13H19N3O2 and molecular weight 249.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[3-(1-methylpyrrolidin-2-yl)-2-pyridinyl] N,N-dimethylcarbamate
Also Known As: Aethanphosphonsaeure-diisopropylester, ethyl-phosphonic acid diisopropyl ester, 3-(1-methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate, 3-(1-Methyl-2-pyrrolidinyl)-2-pyridinyl dimethylcarbamate, [3-(1-methylpyrrolidin-2-yl)pyridin-2-yl] N,N-dimethylcarbamate
| Molecular Formula | C13H19N3O2 |
|---|---|
| Molecular Weight | 249.15 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 45.7 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 3 |
| Exact Mass | 249.14772 |
| Heavy Atoms | 18 |
| Complexity | 296.0 |
Chemical Identifiers
| CAS Number | 1067-69-2 |
|---|---|
| SMILES | CN1CCCC1C2=C(N=CC=C2)OC(=O)N(C)C |
| InChIKey | CXBVRHNOFNLISC-UHFFFAOYSA-N |
Product Overview
3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate (CAS 1067-69-2), with molecular formula C13H19N3O2 and molecular weight 249.15 g/mol. IUPAC: [3-(1-methylpyrrolidin-2-yl)-2-pyridinyl] N,N-dimethylcarbamate.
Chemical Property Profile of 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate
Property Insights of 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate. With a topological polar surface area (TPSA) of 45.7 Ų, 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate has 0 hydrogen bond donor(s) and 4 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 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate?
The CAS number of 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate is 1067-69-2.
What is the molecular formula of 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate?
The molecular formula of 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate is C13H19N3O2.
What is the molecular weight of 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate?
The molecular weight of 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate is 249.15 g/mol.
Where can I buy 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate?
You can request a quote for 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate?
Yes, KEHONG BIO provides custom synthesis services for 3-(1-Methylpyrrolidin-2-yl)pyridin-2-yl dimethylcarbamate and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.