2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)-
TL;DR: 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)- (CAS 42772-51-0) is a chemical compound with molecular formula C10H17NO3 and molecular weight 199.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(hydroxymethyl)-N-(2-methyl-4-oxopentan-2-yl)prop-2-enamide
Also Known As: Hydroxymethyl diacetone acrylamide, HYDROXYMETHYLDIACETONEACRYLAMIDE, 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)-, N-(hydroxymethyl)-N-(2-methyl-4-oxopentan-2-yl)prop-2-enamide, Hydroxymethyl diacetone acrylamide 55% in water
| Molecular Formula | C10H17NO3 |
|---|---|
| Molecular Weight | 199.12 g/mol |
| LogP | 0.0 |
| Topological Polar Surface Area | 57.6 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 5 |
| Exact Mass | 199.12085 |
| Heavy Atoms | 14 |
| Complexity | 246.0 |
Chemical Identifiers
| CAS Number | 42772-51-0 |
|---|---|
| SMILES | CC(=O)CC(C)(C)N(CO)C(=O)C=C |
| InChIKey | WNUPGDZWJCHVAF-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 1 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)- (CAS 42772-51-0), with molecular formula C10H17NO3 and molecular weight 199.12 g/mol. IUPAC: N-(hydroxymethyl)-N-(2-methyl-4-oxopentan-2-yl)prop-2-enamide.
Chemical Property Profile of 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)-
Property Insights of 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)-
The XLogP value of 0.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)-. With a topological polar surface area (TPSA) of 57.6 Ų, 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)- 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-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)-?
The CAS number of 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)- is 42772-51-0.
What is the molecular formula of 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)-?
The molecular formula of 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)- is C10H17NO3.
What is the molecular weight of 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)-?
The molecular weight of 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)- is 199.12 g/mol.
Where can I buy 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)-?
You can request a quote for 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)-?
Yes, KEHONG BIO provides custom synthesis services for 2-Propenamide, N-(1,1-dimethyl-3-oxobutyl)-N-(hydroxymethyl)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.