Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)-
TL;DR: Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)- (CAS 101831-78-1) is a chemical compound with molecular formula C15H18N4 and molecular weight 254.15315 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
3-[(4-methylpiperazin-1-yl)methyl]-1H-indole-5-carbonitrile
Also Known As: 5-Cyano-3-(N-methylpiperazinomethyl)indole, 3-(4-Methyl-1-piperazinyl)methylindole-5-carbonitrile, INDOLE-5-CARBONITRILE, 3-(4-METHYL-1-PIPERAZINYLMETHYL)-, 3-[(4-methylpiperazin-1-yl)methyl]-1H-indole-5-carbonitrile
Technical Specifications
| Molecular Formula | C15H18N4 |
| Molecular Weight | 254.15315 g/mol |
| XLogP | 1.4 |
| Topological Polar Surface Area (TPSA) | 46.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 254.15315 Da |
| Heavy Atoms | 19 |
| Complexity | 352.0 |
| SMILES | CN1CCN(CC1)CC2=CNC3=C2C=C(C=C3)C#N |
| InChIKey | PVNWVAMWFWITOQ-UHFFFAOYSA-N |
Chemical Property Profile of Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)-
Property Insights of Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)-
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)-. With a topological polar surface area (TPSA) of 46.1 Ų, Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)- 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
What is the CAS number of Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)-?
The CAS number of Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)- is 101831-78-1.
What is the molecular formula of Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)-?
The molecular formula of Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)- is C15H18N4.
What is the molecular weight of Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)-?
The molecular weight of Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)- is 254.15315 g/mol.
Where can I buy Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)-?
You can request a quote for Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)- directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)-?
Yes, CoreyChem provides custom synthesis services for Indole-5-carbonitrile, 3-(4-methyl-1-piperazinylmethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.