6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile
TL;DR: 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile (CAS 139156-94-8) is a chemical compound with molecular formula C15H13N3O and molecular weight 251.10587 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
2-amino-3-benzoyl-6,7-dihydro-5H-pyrrolizine-1-carbonitrile
Also Known As: SDCCGMLS-0044183.P002, 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile, 2-amino-3-benzoyl-6,7-dihydro-5H-pyrrolizine-1-carbonitrile, AB00074799-01, AH-262/34641060
Technical Specifications
| Molecular Formula | C15H13N3O |
| Molecular Weight | 251.10587 g/mol |
| XLogP | 2.3 |
| Topological Polar Surface Area (TPSA) | 71.8 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 251.10587 Da |
| Heavy Atoms | 19 |
| Complexity | 407.0 |
| SMILES | C1CC2=C(C(=C(N2C1)C(=O)C3=CC=CC=C3)N)C#N |
| InChIKey | FBXJWKUKZNYWEE-UHFFFAOYSA-N |
Chemical Property Profile of 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile
Property Insights of 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile
The XLogP value of 2.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile. The TPSA of 71.8 Ų falls within the moderate polarity range, balancing permeability and solubility for 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile. Following Lipinski's Rule of Five, 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile 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
What is the CAS number of 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile?
The CAS number of 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile is 139156-94-8.
What is the molecular formula of 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile?
The molecular formula of 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile is C15H13N3O.
What is the molecular weight of 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile?
The molecular weight of 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile is 251.10587 g/mol.
Where can I buy 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile?
You can request a quote for 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile?
Yes, CoreyChem provides custom synthesis services for 6-amino-5-benzoyl-2,3-dihydro-1H-pyrrolizine-7-carbonitrile and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.