2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
TL;DR: 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide (CAS 289686-55-1) is a chemical compound with molecular formula C16H25N3O and molecular weight 275.20 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
Also Known As: BAS 06858299, 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide, 2,2-dimethyl-N-[4-(4-methylpiperazino)phenyl]propanamide, N-(4-(4-methylpiperazin-1-yl)phenyl)pivalamide, 2,2-Dimethyl-N-[4-(4-methyl-piperazin-1-yl)-phenyl]-propionamide
| Molecular Formula | C16H25N3O |
|---|---|
| Molecular Weight | 275.20 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 35.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 275.19977 |
| Heavy Atoms | 20 |
| Complexity | 321.0 |
Chemical Identifiers
| CAS Number | 289686-55-1 |
|---|---|
| SMILES | CC(C)(C)C(=O)NC1=CC=C(C=C1)N2CCN(CC2)C |
| InChIKey | VGKLBBVJPYOFOY-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide (CAS 289686-55-1), with molecular formula C16H25N3O and molecular weight 275.20 g/mol. IUPAC: 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide.
Chemical Property Profile of 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
Property Insights of 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide. With a topological polar surface area (TPSA) of 35.6 Ų, 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide 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 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide?
The CAS number of 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide is 289686-55-1.
What is the molecular formula of 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide?
The molecular formula of 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide is C16H25N3O.
What is the molecular weight of 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide?
The molecular weight of 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide is 275.20 g/mol.
Where can I buy 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide?
You can request a quote for 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide?
Yes, KEHONG BIO provides custom synthesis services for 2,2-dimethyl-N-[4-(4-methylpiperazin-1-yl)phenyl]propanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.