2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1)
TL;DR: 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1) (CAS 63445-63-6) is a chemical compound with molecular formula C16H20ClNO and molecular weight 277.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2,5-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-one;hydrochloride
Also Known As: 2,5-Dimethyl-1-(3-phenyl-2-propynyl)-4-piperidone hydrochloride, 4-Piperidone, 2,5-dimethyl-1-(3-phenyl-2-propynyl)-, hydrochloride, 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1), 2,5-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-one hydrochloride, RefChem:1060102
| Molecular Formula | C16H20ClNO |
|---|---|
| Molecular Weight | 277.12 g/mol |
| LogP | 2.7593 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 277.12335 |
| Heavy Atoms | 19 |
| Complexity | 474.51746 |
Chemical Identifiers
| CAS Number | 63445-63-6 |
|---|---|
| SMILES | CC1CC(=O)C(CN1CC#CC2=CC=CC=C2)C.Cl |
Product Overview
2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1) (CAS 63445-63-6), with molecular formula C16H20ClNO and molecular weight 277.12 g/mol. IUPAC: 2,5-dimethyl-1-(3-phenylprop-2-ynyl)piperidin-4-one;hydrochloride.
Chemical Property Profile of 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1)
Property Insights of 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1)
The XLogP value of 2.7593 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1). With a topological polar surface area (TPSA) of 20.31 Ų, 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1) 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 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1)?
The CAS number of 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1) is 63445-63-6.
What is the molecular formula of 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1)?
The molecular formula of 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1) is C16H20ClNO.
What is the molecular weight of 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1)?
The molecular weight of 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1) is 277.12 g/mol.
Where can I buy 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1)?
You can request a quote for 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1)?
Yes, KEHONG BIO provides custom synthesis services for 2,5-Dimethyl-1-(3-phenylprop-2-yn-1-yl)piperidin-4-one--hydrogen chloride (1/1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.