(2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one
TL;DR: (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one (CAS 30670-98-5) is a chemical compound with molecular formula C10H19NO and molecular weight 169.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2S,5R)-2,5-dimethyl-1-propan-2-ylpiperidin-4-one
Also Known As: ZERO/005457, (2S,5R)-2,5-dimethyl-1-propan-2-ylpiperidin-4-one, AB01334880-02, (2{S},5{R})-1-isopropyl-2,5-dimethylpiperidin-4-one, (2S,5R)-2,5-dimethyl-1-(propan-2-yl)piperidin-4-one
| Molecular Formula | C10H19NO |
|---|---|
| Molecular Weight | 169.15 g/mol |
| LogP | 1.6942 |
| Topological Polar Surface Area | 20.31 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 1 |
| Exact Mass | 169.14667 |
| Heavy Atoms | 12 |
| Complexity | 176.6774 |
Chemical Identifiers
| CAS Number | 30670-98-5 |
|---|---|
| SMILES | C[C@H]1CC(=O)[C@@H](CN1C(C)C)C |
Product Overview
(2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one (CAS 30670-98-5), with molecular formula C10H19NO and molecular weight 169.15 g/mol. IUPAC: (2S,5R)-2,5-dimethyl-1-propan-2-ylpiperidin-4-one.
Chemical Property Profile of (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one
Property Insights of (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one
The XLogP value of 1.6942 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one. With a topological polar surface area (TPSA) of 20.31 Ų, (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-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 (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one?
The CAS number of (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one is 30670-98-5.
What is the molecular formula of (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one?
The molecular formula of (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one is C10H19NO.
What is the molecular weight of (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one?
The molecular weight of (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one is 169.15 g/mol.
Where can I buy (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one?
You can request a quote for (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one?
Yes, KEHONG BIO provides custom synthesis services for (2S,5R)-2,5-dimethyl-1-(methylethyl)piperidin-4-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.