rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine
TL;DR: rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine (CAS 567-38-4) is a chemical compound with molecular formula C8H15N and molecular weight 125.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(1R,8S)-1-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine
Also Known As: Pseudoheliotridane, (-)-Heliotridane, (-)-Pseudoheliotridane, rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine, (1R,7aS)-1-Methylhexahydro-1H-pyrrolizine
| Molecular Formula | C8H15N |
|---|---|
| Molecular Weight | 125.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 3.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 0 |
| Exact Mass | 125.12045 |
| Heavy Atoms | 9 |
| Complexity | 111.0 |
Chemical Identifiers
| CAS Number | 567-38-4 |
|---|---|
| SMILES | C[C@@H]1CCN2[C@H]1CCC2 |
| InChIKey | BFHBAQJJQJPDGF-SFYZADRCSA-N |
Product Overview
rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine (CAS 567-38-4), with molecular formula C8H15N and molecular weight 125.12 g/mol. IUPAC: (1R,8S)-1-methyl-2,3,5,6,7,8-hexahydro-1H-pyrrolizine.
Chemical Property Profile of rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine
Property Insights of rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine. With a topological polar surface area (TPSA) of 3.2 Ų, rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine has 0 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 rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine?
The CAS number of rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine is 567-38-4.
What is the molecular formula of rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine?
The molecular formula of rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine is C8H15N.
What is the molecular weight of rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine?
The molecular weight of rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine is 125.12 g/mol.
Where can I buy rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine?
You can request a quote for rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine?
Yes, KEHONG BIO provides custom synthesis services for rel-(1R,7aS)-1-methylhexahydro-1H-pyrrolizine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.