1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride
TL;DR: 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride (CAS 15621-33-7) is a chemical compound with molecular formula C13H17ClN2O2 and molecular weight 268.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(7-oxocyclohepta-1,3,5-trien-1-yl)-2-pyrrolidin-1-ylacetamide;hydrochloride
Also Known As: 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride, N-(7-Oxo-1,3,5-cycloheptatrien-1-yl)-1-pyrrolidineacetamide hydrochloride, N-(7-oxocyclohepta-1,3,5-trien-1-yl)-2-pyrrolidin-1-ylacetamide hydrochloride, N-(7-Oxocyclohepta-1,3,5-trien-1-yl)-2-(pyrrolidin-1-yl)acetamide--hydrogen chloride (1/1), RefChem:235181
| Molecular Formula | C13H17ClN2O2 |
|---|---|
| Molecular Weight | 268.10 g/mol |
| LogP | 1.5029 |
| Topological Polar Surface Area | 49.4 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 268.09787 |
| Heavy Atoms | 18 |
| Complexity | 402.0 |
Chemical Identifiers
| CAS Number | 15621-33-7 |
|---|---|
| SMILES | C1CCN(C1)CC(=O)NC2=CC=CC=CC2=O.Cl |
| InChIKey | CQFPNLKUOWHQKX-UHFFFAOYSA-N |
Product Overview
1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride (CAS 15621-33-7), with molecular formula C13H17ClN2O2 and molecular weight 268.10 g/mol. IUPAC: N-(7-oxocyclohepta-1,3,5-trien-1-yl)-2-pyrrolidin-1-ylacetamide;hydrochloride.
Chemical Property Profile of 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride
Property Insights of 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride
The XLogP value of 1.5029 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride. With a topological polar surface area (TPSA) of 49.4 Ų, 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride 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 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride?
The CAS number of 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride is 15621-33-7.
What is the molecular formula of 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride?
The molecular formula of 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride is C13H17ClN2O2.
What is the molecular weight of 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride?
The molecular weight of 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride is 268.10 g/mol.
Where can I buy 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride?
You can request a quote for 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride?
Yes, KEHONG BIO provides custom synthesis services for 1-Pyrrolidineacetamide, N-(7-oxo-1,3,5-cycloheptatrien-1-yl)-, monohydrochloride and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.