1-(Diethylamino)-3H-pyrrolizin-3-one
TL;DR: 1-(Diethylamino)-3H-pyrrolizin-3-one (CAS 96193-27-0) is a chemical compound with molecular formula C11H14N2O and molecular weight 190.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-(diethylamino)pyrrolizin-3-one
Also Known As: 1-(Diethylamino)-3H-pyrrolizin-3-one, 1-(diethylamino)pyrrolizin-3-one, 1-diethylamino-pyrrolizin-3-one, 3H-PYRROLIZIN-3-ONE, 1-(DIETHYLAMINO)-, RefChem:74675
| Molecular Formula | C11H14N2O |
|---|---|
| Molecular Weight | 190.11 g/mol |
| LogP | 1.4 |
| Topological Polar Surface Area | 25.2 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 190.11061 |
| Heavy Atoms | 14 |
| Complexity | 268.0 |
Chemical Identifiers
| CAS Number | 96193-27-0 |
|---|---|
| SMILES | CCN(CC)C1=CC(=O)N2C1=CC=C2 |
| InChIKey | OAPBNMOWKFMKIS-UHFFFAOYSA-N |
Product Overview
1-(Diethylamino)-3H-pyrrolizin-3-one (CAS 96193-27-0), with molecular formula C11H14N2O and molecular weight 190.11 g/mol. IUPAC: 1-(diethylamino)pyrrolizin-3-one.
Chemical Property Profile of 1-(Diethylamino)-3H-pyrrolizin-3-one
Property Insights of 1-(Diethylamino)-3H-pyrrolizin-3-one
The XLogP value of 1.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(Diethylamino)-3H-pyrrolizin-3-one. With a topological polar surface area (TPSA) of 25.2 Ų, 1-(Diethylamino)-3H-pyrrolizin-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(Diethylamino)-3H-pyrrolizin-3-one has 0 hydrogen bond donor(s) and 2 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-(Diethylamino)-3H-pyrrolizin-3-one?
The CAS number of 1-(Diethylamino)-3H-pyrrolizin-3-one is 96193-27-0.
What is the molecular formula of 1-(Diethylamino)-3H-pyrrolizin-3-one?
The molecular formula of 1-(Diethylamino)-3H-pyrrolizin-3-one is C11H14N2O.
What is the molecular weight of 1-(Diethylamino)-3H-pyrrolizin-3-one?
The molecular weight of 1-(Diethylamino)-3H-pyrrolizin-3-one is 190.11 g/mol.
Where can I buy 1-(Diethylamino)-3H-pyrrolizin-3-one?
You can request a quote for 1-(Diethylamino)-3H-pyrrolizin-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(Diethylamino)-3H-pyrrolizin-3-one?
Yes, KEHONG BIO provides custom synthesis services for 1-(Diethylamino)-3H-pyrrolizin-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.