2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl-
TL;DR: 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl- (CAS 54839-86-0) is a chemical compound with molecular formula C16H21N3O2 and molecular weight 287.16 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-anilino-4-(piperidine-1-carbonyl)pyrrolidin-2-one
Also Known As: 1-Anilino-4-piperidinocarbonyl-2-pyrrolidinone, 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl-, 1-anilino-4-(piperidine-1-carbonyl)pyrrolidin-2-one, 1-(phenylamino)-4-(piperidin-1-ylcarbonyl)pyrrolidin-2-one, 5-22-06-00048 (Beilstein Handbook Reference)
| Molecular Formula | C16H21N3O2 |
|---|---|
| Molecular Weight | 287.16 g/mol |
| LogP | 1.6 |
| Topological Polar Surface Area | 52.7 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 3 |
| Exact Mass | 287.1634 |
| Heavy Atoms | 21 |
| Complexity | 387.0 |
Chemical Identifiers
| CAS Number | 54839-86-0 |
|---|---|
| SMILES | C1CCN(CC1)C(=O)C2CC(=O)N(C2)NC3=CC=CC=C3 |
| InChIKey | JFZUQYGYJQWVDK-UHFFFAOYSA-N |
Product Overview
2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl- (CAS 54839-86-0), with molecular formula C16H21N3O2 and molecular weight 287.16 g/mol. IUPAC: 1-anilino-4-(piperidine-1-carbonyl)pyrrolidin-2-one.
Chemical Property Profile of 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl-
Property Insights of 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl-
The XLogP value of 1.6 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl-. With a topological polar surface area (TPSA) of 52.7 Ų, 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl- 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
Frequently Asked Questions
What is the CAS number of 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl-?
The CAS number of 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl- is 54839-86-0.
What is the molecular formula of 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl-?
The molecular formula of 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl- is C16H21N3O2.
What is the molecular weight of 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl-?
The molecular weight of 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl- is 287.16 g/mol.
Where can I buy 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl-?
You can request a quote for 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl-?
Yes, KEHONG BIO provides custom synthesis services for 2-Pyrrolidinone, 1-anilino-4-piperidinocarbonyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.