1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride
TL;DR: 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride (CAS 14415-57-7) is a chemical compound with molecular formula C16H27ClN2O2 and molecular weight 314.18 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethyl-1-[1-(2-morpholin-4-ium-4-ylethyl)pyrrol-2-yl]butan-1-one chloride
Also Known As: 2-Ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-1-butanone hydrochloride, 1-BUTANONE, 2-ETHYL-1-(1-(2-MORPHOLINOETHYL)-2-PYRROLYL)-, MONOHYDROCHLORIDE, 2-ethyl-1-[1-(2-morpholin-4-ium-4-ylethyl)pyrrol-2-yl]butan-1-one chloride, RefChem:228896
| Molecular Formula | C16H27ClN2O2 |
|---|---|
| Molecular Weight | 314.18 g/mol |
| LogP | -1.97 |
| Topological Polar Surface Area | 35.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 7 |
| Exact Mass | 314.17612 |
| Heavy Atoms | 21 |
| Complexity | 299.0 |
Chemical Identifiers
| CAS Number | 14415-57-7 |
|---|---|
| SMILES | CCC(CC)C(=O)C1=CC=CN1CC[NH+]2CCOCC2.[Cl-] |
| InChIKey | MWEJFGMIYCJLTF-UHFFFAOYSA-N |
Product Overview
1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride (CAS 14415-57-7), with molecular formula C16H27ClN2O2 and molecular weight 314.18 g/mol. IUPAC: 2-ethyl-1-[1-(2-morpholin-4-ium-4-ylethyl)pyrrol-2-yl]butan-1-one chloride.
Chemical Property Profile of 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride
Property Insights of 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride
The XLogP value of -1.97 indicates that 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride is hydrophilic (water-soluble), making it suitable for aqueous formulations and biological assay applications. With a topological polar surface area (TPSA) of 35.7 Ų, 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride 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 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride?
The CAS number of 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride is 14415-57-7.
What is the molecular formula of 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride?
The molecular formula of 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride is C16H27ClN2O2.
What is the molecular weight of 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride?
The molecular weight of 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride is 314.18 g/mol.
Where can I buy 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride?
You can request a quote for 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Butanone, 2-ethyl-1-(1-(2-morpholinoethyl)-2-pyrrolyl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.