N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline
TL;DR: N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline (CAS 198563-63-2) is a chemical compound with molecular formula C14H21N3O and molecular weight 247.17 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
[4-(dimethylamino)phenyl]-(4-methylpiperazin-1-yl)methanone
Also Known As: BAS 00785640, N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline, 1-[4-(Dimethylamino)benzoyl]-4-methylpiperazine, 4-(Dimethylamino)phenyl 4-methylpiperazino ketone, [4-(dimethylamino)phenyl](4-methylpiperazin-1-yl)methanone
| Molecular Formula | C14H21N3O |
|---|---|
| Molecular Weight | 247.17 g/mol |
| LogP | 0.5 |
| Topological Polar Surface Area | 26.8 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.16846 |
| Heavy Atoms | 18 |
| Complexity | 277.0 |
Chemical Identifiers
| CAS Number | 198563-63-2 |
|---|---|
| SMILES | CN1CCN(CC1)C(=O)C2=CC=C(C=C2)N(C)C |
| InChIKey | TWKHHNPMWQKOEF-UHFFFAOYSA-N |
Product Overview
N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline (CAS 198563-63-2), with molecular formula C14H21N3O and molecular weight 247.17 g/mol. IUPAC: [4-(dimethylamino)phenyl]-(4-methylpiperazin-1-yl)methanone.
Chemical Property Profile of N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline
Property Insights of N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline
The XLogP value of 0.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline. With a topological polar surface area (TPSA) of 26.8 Ų, N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline has 0 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 N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline?
The CAS number of N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline is 198563-63-2.
What is the molecular formula of N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline?
The molecular formula of N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline is C14H21N3O.
What is the molecular weight of N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline?
The molecular weight of N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline is 247.17 g/mol.
Where can I buy N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline?
You can request a quote for N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline?
Yes, KEHONG BIO provides custom synthesis services for N,N-dimethyl-4-(4-methylpiperazine-1-carbonyl)aniline and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.