3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1)
TL;DR: 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1) (CAS 96145-85-6) is a chemical compound with molecular formula C11H20ClNO and molecular weight 217.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-methyl-5-piperidin-1-ylpent-3-yn-2-ol;hydrochloride
Also Known As: 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1), 2-methyl-5-(1-piperidyl)pent-3-yn-2-ol Hydrochloride, 2-methyl-5-piperidin-1-ylpent-3-yn-2-ol hydrochloride, 2-methyl-5-piperidin-1-ylpent-3-yn-2-ol,hydrochloride, 2-Methyl-5-(piperidin-1-yl)pent-3-yn-2-ol--hydrogen chloride (1/1)
| Molecular Formula | C11H20ClNO |
|---|---|
| Molecular Weight | 217.12 g/mol |
| LogP | 1.6684 |
| Topological Polar Surface Area | 23.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 2 |
| Exact Mass | 217.12334 |
| Heavy Atoms | 14 |
| Complexity | 215.0 |
Chemical Identifiers
| CAS Number | 96145-85-6 |
|---|---|
| SMILES | CC(C)(C#CCN1CCCCC1)O.Cl |
| InChIKey | WYPOIQNJHOXJGL-UHFFFAOYSA-N |
Product Overview
3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1) (CAS 96145-85-6), with molecular formula C11H20ClNO and molecular weight 217.12 g/mol. IUPAC: 2-methyl-5-piperidin-1-ylpent-3-yn-2-ol;hydrochloride.
Chemical Property Profile of 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1)
Property Insights of 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1)
The XLogP value of 1.6684 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1). With a topological polar surface area (TPSA) of 23.5 Ų, 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1) exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1) has 2 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 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1)?
The CAS number of 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1) is 96145-85-6.
What is the molecular formula of 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1)?
The molecular formula of 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1) is C11H20ClNO.
What is the molecular weight of 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1)?
The molecular weight of 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1) is 217.12 g/mol.
Where can I buy 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1)?
You can request a quote for 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1) directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1)?
Yes, KEHONG BIO provides custom synthesis services for 3-Pentyn-2-ol, 2-methyl-5-(1-piperidinyl)-, hydrochloride (1:1) and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.