4-Piperidinone, 1-methyl-3-(phenylmethylene)-
TL;DR: 4-Piperidinone, 1-methyl-3-(phenylmethylene)- (CAS 71133-62-5) is a chemical compound with molecular formula C13H15NO and molecular weight 201.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
3-benzylidene-1-methylpiperidin-4-one
Also Known As: 3-benzylidene-1-methylpiperidin-4-one, (E)-3-Benzylidene-1-methylpiperidin-4-one, NCI60_007014, 4-Piperidinone, 1-methyl-3-(phenylmethylene)-
| Molecular Formula | C13H15NO |
|---|---|
| Molecular Weight | 201.12 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 201.11537 |
| Heavy Atoms | 15 |
| Complexity | 264.0 |
Chemical Identifiers
| CAS Number | 71133-62-5 |
|---|---|
| SMILES | CN1CCC(=O)C(=CC2=CC=CC=C2)C1 |
| InChIKey | BDUHZWSOKZFPEJ-UHFFFAOYSA-N |
Product Overview
4-Piperidinone, 1-methyl-3-(phenylmethylene)- (CAS 71133-62-5), with molecular formula C13H15NO and molecular weight 201.12 g/mol. IUPAC: 3-benzylidene-1-methylpiperidin-4-one.
Chemical Property Profile of 4-Piperidinone, 1-methyl-3-(phenylmethylene)-
Property Insights of 4-Piperidinone, 1-methyl-3-(phenylmethylene)-
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 4-Piperidinone, 1-methyl-3-(phenylmethylene)-. With a topological polar surface area (TPSA) of 20.3 Ų, 4-Piperidinone, 1-methyl-3-(phenylmethylene)- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 4-Piperidinone, 1-methyl-3-(phenylmethylene)- 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 4-Piperidinone, 1-methyl-3-(phenylmethylene)-?
The CAS number of 4-Piperidinone, 1-methyl-3-(phenylmethylene)- is 71133-62-5.
What is the molecular formula of 4-Piperidinone, 1-methyl-3-(phenylmethylene)-?
The molecular formula of 4-Piperidinone, 1-methyl-3-(phenylmethylene)- is C13H15NO.
What is the molecular weight of 4-Piperidinone, 1-methyl-3-(phenylmethylene)-?
The molecular weight of 4-Piperidinone, 1-methyl-3-(phenylmethylene)- is 201.12 g/mol.
Where can I buy 4-Piperidinone, 1-methyl-3-(phenylmethylene)-?
You can request a quote for 4-Piperidinone, 1-methyl-3-(phenylmethylene)- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 4-Piperidinone, 1-methyl-3-(phenylmethylene)-?
Yes, KEHONG BIO provides custom synthesis services for 4-Piperidinone, 1-methyl-3-(phenylmethylene)- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.