2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo-
TL;DR: 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo- (CAS 464223-84-5) is a chemical compound with molecular formula C11H17NO3 and molecular weight 211.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
4-(2-ethylpiperidin-1-yl)-4-oxobut-2-enoic acid
Also Known As: 4-(2-ethyl-1-piperidyl)-4-oxo-but-2-enoic Acid, 4-(2-ethylpiperidin-1-yl)-4-oxobut-2-enoic acid, 2-BUTENOIC ACID, 4-(2-ETHYL-1-PIPERIDINYL)-4-OXO-, 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo- (9CI)
| Molecular Formula | C11H17NO3 |
|---|---|
| Molecular Weight | 211.12 g/mol |
| LogP | 1.4183 |
| Topological Polar Surface Area | 57.61 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 211.12085 |
| Heavy Atoms | 15 |
| Complexity | 273.0066 |
Chemical Identifiers
| CAS Number | 464223-84-5 |
|---|---|
| SMILES | CCC1CCCCN1C(=O)C=CC(=O)O |
Product Overview
2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo- (CAS 464223-84-5), with molecular formula C11H17NO3 and molecular weight 211.12 g/mol. IUPAC: 4-(2-ethylpiperidin-1-yl)-4-oxobut-2-enoic acid.
Chemical Property Profile of 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo-
Property Insights of 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo-
The XLogP value of 1.4183 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo-. With a topological polar surface area (TPSA) of 57.61 Ų, 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo- has 1 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-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo-?
The CAS number of 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo- is 464223-84-5.
What is the molecular formula of 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo-?
The molecular formula of 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo- is C11H17NO3.
What is the molecular weight of 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo-?
The molecular weight of 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo- is 211.12 g/mol.
Where can I buy 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo-?
You can request a quote for 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo-?
Yes, KEHONG BIO provides custom synthesis services for 2-Butenoic acid, 4-(2-ethyl-1-piperidinyl)-4-oxo- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.