1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile
TL;DR: 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile (CAS 180386-30-5) is a chemical compound with molecular formula C21H25N3 and molecular weight 319.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-benzyl-4-(2-phenylethylamino)piperidine-4-carbonitrile
Also Known As: Maybridge3_004135, 1-benzyl-4-(phenethylamino)piperidine-4-carbonitrile, IDI1_015522
| Molecular Formula | C21H25N3 |
|---|---|
| Molecular Weight | 319.20 g/mol |
| LogP | 3.37708 |
| Topological Polar Surface Area | 39.06 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 6 |
| Exact Mass | 319.20483 |
| Heavy Atoms | 24 |
| Complexity | 652.48816 |
Chemical Identifiers
| CAS Number | 180386-30-5 |
|---|---|
| SMILES | C1CN(CCC1(C#N)NCCC2=CC=CC=C2)CC3=CC=CC=C3 |
Product Overview
1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile (CAS 180386-30-5), with molecular formula C21H25N3 and molecular weight 319.20 g/mol. IUPAC: 1-benzyl-4-(2-phenylethylamino)piperidine-4-carbonitrile.
Chemical Property Profile of 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile
Property Insights of 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile
The XLogP value of 3.37708 indicates that 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile is lipophilic (fat-soluble), which may influence its absorption, distribution, and formulation strategy. With a topological polar surface area (TPSA) of 39.06 Ų, 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile 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 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile?
The CAS number of 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile is 180386-30-5.
What is the molecular formula of 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile?
The molecular formula of 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile is C21H25N3.
What is the molecular weight of 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile?
The molecular weight of 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile is 319.20 g/mol.
Where can I buy 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile?
You can request a quote for 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile?
Yes, KEHONG BIO provides custom synthesis services for 1-Benzyl-4-(phenethylamino)piperidine-4-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.