2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile
TL;DR: 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile (CAS 37673-07-7) is a chemical compound with molecular formula C15H20N2O2 and molecular weight 260.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(3,4-dimethoxyphenyl)-2-piperidin-1-ylacetonitrile
Also Known As: IFLab1_004092, 2-(3,4-dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile, BAS 00890351, 2-(3,4-dimethoxyphenyl)-2-piperidin-1-ylacetonitrile, (3,4-dimethoxyphenyl)(1-piperidinyl)acetonitrile
| Molecular Formula | C15H20N2O2 |
|---|---|
| Molecular Weight | 260.15 g/mol |
| LogP | 2.75438 |
| Topological Polar Surface Area | 45.49 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 4 |
| Exact Mass | 260.15247 |
| Heavy Atoms | 19 |
| Complexity | 461.70364 |
Chemical Identifiers
| CAS Number | 37673-07-7 |
|---|---|
| SMILES | COC1=C(C=C(C=C1)C(C#N)N2CCCCC2)OC |
Product Overview
2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile (CAS 37673-07-7), with molecular formula C15H20N2O2 and molecular weight 260.15 g/mol. IUPAC: 2-(3,4-dimethoxyphenyl)-2-piperidin-1-ylacetonitrile.
Chemical Property Profile of 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile
Property Insights of 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile
The XLogP value of 2.75438 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile. With a topological polar surface area (TPSA) of 45.49 Ų, 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile 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 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile?
The CAS number of 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile is 37673-07-7.
What is the molecular formula of 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile?
The molecular formula of 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile is C15H20N2O2.
What is the molecular weight of 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile?
The molecular weight of 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile is 260.15 g/mol.
Where can I buy 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile?
You can request a quote for 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(3,4-Dimethoxyphenyl)-2-(piperidin-1-yl)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.