N-propan-2-ylprop-2-enamide;prop-2-enoic acid
TL;DR: N-propan-2-ylprop-2-enamide;prop-2-enoic acid (CAS 79042-19-6) is a chemical compound with molecular formula C9H15NO3 and molecular weight 185.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-propan-2-ylprop-2-enamide;prop-2-enoic acid
Also Known As: N-isopropylacrylamide acrylic acid, 1,2,3,4-Tetramethyl-cyclopentane, (C6-H11-N-O.C3-H4-O2)x-, N-propan-2-ylprop-2-enamide; prop-2-enoic acid, N-propan-2-ylprop-2-enamide,prop-2-enoic acid
| Molecular Formula | C9H15NO3 |
|---|---|
| Molecular Weight | 185.11 g/mol |
| LogP | 0.954 |
| Topological Polar Surface Area | 66.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 185.1052 |
| Heavy Atoms | 13 |
| Complexity | 153.0 |
Chemical Identifiers
| CAS Number | 79042-19-6 |
|---|---|
| SMILES | CC(C)NC(=O)C=C.C=CC(=O)O |
| InChIKey | KDOBOUDNGLERSD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-propan-2-ylprop-2-enamide;prop-2-enoic acid (CAS 79042-19-6), with molecular formula C9H15NO3 and molecular weight 185.11 g/mol. IUPAC: N-propan-2-ylprop-2-enamide;prop-2-enoic acid.
Chemical Property Profile of N-propan-2-ylprop-2-enamide;prop-2-enoic acid
Property Insights of N-propan-2-ylprop-2-enamide;prop-2-enoic acid
The XLogP value of 0.954 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-propan-2-ylprop-2-enamide;prop-2-enoic acid. The TPSA of 66.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-propan-2-ylprop-2-enamide;prop-2-enoic acid. Following Lipinski's Rule of Five, N-propan-2-ylprop-2-enamide;prop-2-enoic acid has 2 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-propan-2-ylprop-2-enamide;prop-2-enoic acid?
The CAS number of N-propan-2-ylprop-2-enamide;prop-2-enoic acid is 79042-19-6.
What is the molecular formula of N-propan-2-ylprop-2-enamide;prop-2-enoic acid?
The molecular formula of N-propan-2-ylprop-2-enamide;prop-2-enoic acid is C9H15NO3.
What is the molecular weight of N-propan-2-ylprop-2-enamide;prop-2-enoic acid?
The molecular weight of N-propan-2-ylprop-2-enamide;prop-2-enoic acid is 185.11 g/mol.
Where can I buy N-propan-2-ylprop-2-enamide;prop-2-enoic acid?
You can request a quote for N-propan-2-ylprop-2-enamide;prop-2-enoic acid directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-propan-2-ylprop-2-enamide;prop-2-enoic acid?
Yes, KEHONG BIO provides custom synthesis services for N-propan-2-ylprop-2-enamide;prop-2-enoic acid and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.