2,2-Dimethyl-n-benzylmalonamide
TL;DR: 2,2-Dimethyl-n-benzylmalonamide (CAS 402-02-8) is a chemical compound with molecular formula C12H16N2O2 and molecular weight 220.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N'-benzyl-2,2-dimethylpropanediamide
Also Known As: 2,2-Dmnbm, 2,2-Dimethyl-n-benzylmalonamide, n-benzyl-2,2-dimethylpropanediamide, N'-benzyl-2,2-dimethylpropanediamide, N~1~-Benzyl-2,2-dimethylpropanediamide
| Molecular Formula | C12H16N2O2 |
|---|---|
| Molecular Weight | 220.12 g/mol |
| LogP | 1.0 |
| Topological Polar Surface Area | 72.2 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 220.12119 |
| Heavy Atoms | 16 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 402-02-8 |
|---|---|
| SMILES | CC(C)(C(=O)N)C(=O)NCC1=CC=CC=C1 |
| InChIKey | IVDIXZVQCWZQOL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2,2-Dimethyl-n-benzylmalonamide (CAS 402-02-8), with molecular formula C12H16N2O2 and molecular weight 220.12 g/mol. IUPAC: N'-benzyl-2,2-dimethylpropanediamide.
Chemical Property Profile of 2,2-Dimethyl-n-benzylmalonamide
Property Insights of 2,2-Dimethyl-n-benzylmalonamide
The XLogP value of 1.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,2-Dimethyl-n-benzylmalonamide. The TPSA of 72.2 Ų falls within the moderate polarity range, balancing permeability and solubility for 2,2-Dimethyl-n-benzylmalonamide. Following Lipinski's Rule of Five, 2,2-Dimethyl-n-benzylmalonamide has 2 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 2,2-Dimethyl-n-benzylmalonamide?
The CAS number of 2,2-Dimethyl-n-benzylmalonamide is 402-02-8.
What is the molecular formula of 2,2-Dimethyl-n-benzylmalonamide?
The molecular formula of 2,2-Dimethyl-n-benzylmalonamide is C12H16N2O2.
What is the molecular weight of 2,2-Dimethyl-n-benzylmalonamide?
The molecular weight of 2,2-Dimethyl-n-benzylmalonamide is 220.12 g/mol.
Where can I buy 2,2-Dimethyl-n-benzylmalonamide?
You can request a quote for 2,2-Dimethyl-n-benzylmalonamide 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-benzylmalonamide?
Yes, KEHONG BIO provides custom synthesis services for 2,2-Dimethyl-n-benzylmalonamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.