Methyl-diisopropylacetamide
TL;DR: Methyl-diisopropylacetamide (CAS 102450-54-4) is a chemical compound with molecular formula C9H19NO and molecular weight 157.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,3-dimethyl-2-propan-2-ylbutanamide
Also Known As: Methyl-diisopropylacetamide, 2-Isopropyl-2,3-dimethylbutanamide, 2-Isopropyl-2,3-dimethylbutanamide #, 2,3-dimethyl-2-propan-2-ylbutanamide, 2-isopropyl-2,3-dimethyl-butyric acid amide
| Molecular Formula | C9H19NO |
|---|---|
| Molecular Weight | 157.15 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 157.14667 |
| Heavy Atoms | 11 |
| Complexity | 142.0 |
Chemical Identifiers
| CAS Number | 102450-54-4 |
|---|---|
| SMILES | CC(C)C(C)(C(C)C)C(=O)N |
| InChIKey | KNFALXJEYYMXKE-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Methyl-diisopropylacetamide (CAS 102450-54-4), with molecular formula C9H19NO and molecular weight 157.15 g/mol. IUPAC: 2,3-dimethyl-2-propan-2-ylbutanamide.
Chemical Property Profile of Methyl-diisopropylacetamide
Property Insights of Methyl-diisopropylacetamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Methyl-diisopropylacetamide. With a topological polar surface area (TPSA) of 43.1 Ų, Methyl-diisopropylacetamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Methyl-diisopropylacetamide has 1 hydrogen bond donor(s) and 1 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 Methyl-diisopropylacetamide?
The CAS number of Methyl-diisopropylacetamide is 102450-54-4.
What is the molecular formula of Methyl-diisopropylacetamide?
The molecular formula of Methyl-diisopropylacetamide is C9H19NO.
What is the molecular weight of Methyl-diisopropylacetamide?
The molecular weight of Methyl-diisopropylacetamide is 157.15 g/mol.
Where can I buy Methyl-diisopropylacetamide?
You can request a quote for Methyl-diisopropylacetamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Methyl-diisopropylacetamide?
Yes, KEHONG BIO provides custom synthesis services for Methyl-diisopropylacetamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.