2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile
TL;DR: 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile (CAS 100973-38-4) is a chemical compound with molecular formula C15H17N3 and molecular weight 239.14 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-(1H-indol-3-yl)-2-piperidin-1-ylacetonitrile
Also Known As: (3-indolyl)piperidinoacetonitrile, 3-(Piperidinocyanomethyl)-1H-indole, 2-(1H-INDOL-3-YL)-2-(PIPERIDIN-1-YL)ACETONITRILE, BAS 00534952, 2-indol-3-yl-2-piperidylethanenitrile
| Molecular Formula | C15H17N3 |
|---|---|
| Molecular Weight | 239.14 g/mol |
| LogP | 3.21848 |
| Topological Polar Surface Area | 42.82 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 239.14224 |
| Heavy Atoms | 18 |
| Complexity | 572.6814 |
Chemical Identifiers
| CAS Number | 100973-38-4 |
|---|---|
| SMILES | C1CCN(CC1)C(C#N)C2=CNC3=CC=CC=C32 |
Product Overview
2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile (CAS 100973-38-4), with molecular formula C15H17N3 and molecular weight 239.14 g/mol. IUPAC: 2-(1H-indol-3-yl)-2-piperidin-1-ylacetonitrile.
Chemical Property Profile of 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile
Property Insights of 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile
The XLogP value of 3.21848 indicates that 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 42.82 Ų, 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile 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 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile?
The CAS number of 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile is 100973-38-4.
What is the molecular formula of 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile?
The molecular formula of 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile is C15H17N3.
What is the molecular weight of 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile?
The molecular weight of 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile is 239.14 g/mol.
Where can I buy 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile?
You can request a quote for 2-(1H-Indol-3-YL)-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-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile?
Yes, KEHONG BIO provides custom synthesis services for 2-(1H-Indol-3-YL)-2-(piperidin-1-YL)acetonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.