5-(Dimethylamino)-1-phenylpent-1-en-3-one
TL;DR: 5-(Dimethylamino)-1-phenylpent-1-en-3-one (CAS 3469-90-7) is a chemical compound with molecular formula C13H17NO and molecular weight 203.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
5-(dimethylamino)-1-phenylpent-1-en-3-one
Also Known As: 5-Dimethylamino-1-phenyl-1-penten-3-one, styryl beta-dimethylaminoethyl ketone, 5-(Dimethylamino)-1-phenyl-1-penten-3-one, 5-(dimethylamino)-1-phenylpent-1-en-3-one, NCI60_001502
| Molecular Formula | C13H17NO |
|---|---|
| Molecular Weight | 203.13 g/mol |
| LogP | 2.0 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 203.13101 |
| Heavy Atoms | 15 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 3469-90-7 |
|---|---|
| SMILES | CN(C)CCC(=O)C=CC1=CC=CC=C1 |
| InChIKey | JLWRSVWWZYOKTL-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
5-(Dimethylamino)-1-phenylpent-1-en-3-one (CAS 3469-90-7), with molecular formula C13H17NO and molecular weight 203.13 g/mol. IUPAC: 5-(dimethylamino)-1-phenylpent-1-en-3-one.
Chemical Property Profile of 5-(Dimethylamino)-1-phenylpent-1-en-3-one
Property Insights of 5-(Dimethylamino)-1-phenylpent-1-en-3-one
The XLogP value of 2.0 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 5-(Dimethylamino)-1-phenylpent-1-en-3-one. With a topological polar surface area (TPSA) of 20.3 Ų, 5-(Dimethylamino)-1-phenylpent-1-en-3-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 5-(Dimethylamino)-1-phenylpent-1-en-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 5-(Dimethylamino)-1-phenylpent-1-en-3-one?
The CAS number of 5-(Dimethylamino)-1-phenylpent-1-en-3-one is 3469-90-7.
What is the molecular formula of 5-(Dimethylamino)-1-phenylpent-1-en-3-one?
The molecular formula of 5-(Dimethylamino)-1-phenylpent-1-en-3-one is C13H17NO.
What is the molecular weight of 5-(Dimethylamino)-1-phenylpent-1-en-3-one?
The molecular weight of 5-(Dimethylamino)-1-phenylpent-1-en-3-one is 203.13 g/mol.
Where can I buy 5-(Dimethylamino)-1-phenylpent-1-en-3-one?
You can request a quote for 5-(Dimethylamino)-1-phenylpent-1-en-3-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 5-(Dimethylamino)-1-phenylpent-1-en-3-one?
Yes, KEHONG BIO provides custom synthesis services for 5-(Dimethylamino)-1-phenylpent-1-en-3-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.