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5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺
TL;DR: 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺 (CAS 69353-01-1) is a chemical compound with molecular formula C12H19NO and molecular weight 193.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺
2-propylbicyclo[2.2.2]oct-5-ene-2-carboxamide
Also Known As: 5-propylbicyclo[2.2.2]oct-2-ene-5-carboxamide, 5-n-Propylbicyclo(2.2.)oct-2-ene-5-carboxamide, BICYCLO(2.2.2)OCT-2-ENE-5-CARBOXAMIDE, 5-PROPYL-, 2-propylbicyclo[2.2.2]oct-5-ene-2-carboxamide, 2-Propylbicyclo[2.2.2]oct-5-ene-2-carboximidic acid
| Molecular Formula | C12H19NO |
|---|---|
| Molecular Weight | 193.15 g/mol |
| LogP | 2.3 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 193.14667 |
| Heavy Atoms | 14 |
| Complexity | 271.0 |
Chemical Identifiers
| CAS Number | 69353-01-1 |
|---|---|
| SMILES | CCCC1(CC2CCC1C=C2)C(=O)N |
| InChIKey | MYRIRZQNLDFPAY-UHFFFAOYSA-N |
Product Overview
5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺 (CAS 69353-01-1), with molecular formula C12H19NO and molecular weight 193.15 g/mol. IUPAC: 2-propylbicyclo[2.2.2]oct-5-ene-2-carboxamide.
Chemical Property Profile of 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺
Property Insights of 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺. With a topological polar surface area (TPSA) of 43.1 Ų, 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺 has 1 hydrogen bond donor(s) and 1 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 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺?
The CAS number of 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺 is 69353-01-1.
What is the molecular formula of 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺?
The molecular formula of 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺 is C12H19NO.
What is the molecular weight of 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺?
The molecular weight of 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺 is 193.15 g/mol.
Where can I buy 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺?
You can request a quote for 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺?
Yes, KEHONG BIO provides custom synthesis services for 5-丙基双环[2.2.2]辛-2-烯-5-甲酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.