1-Methyl-4-(nitromethyl)piperidin-4-ol
TL;DR: 1-Methyl-4-(nitromethyl)piperidin-4-ol (CAS 116250-49-8) is a chemical compound with molecular formula C7H14N2O3 and molecular weight 174.10045 g/mol, supplied by CoreyChem (Career Henan Chemical Co., Ltd.) with ISO-certified quality and global shipping.
1-methyl-4-(nitromethyl)piperidin-4-ol
Also Known As: 1-methyl-4-(nitromethyl)piperidin-4-ol, 1-Methyl-4-[nitromethyl]-4-piperidinol, Methyl-4[nitromethyl]-4-piperidinol, 1-methyl-4-nitromethylpiperidin-4-ol, F1911-9751
Application Areas
Top 5 of 2 IPC patent classification(s) from the SureChEMBL global patent database.
Technical Specifications
| Molecular Formula | C7H14N2O3 |
| Molecular Weight | 174.10045 g/mol |
| XLogP | 0.3 |
| Topological Polar Surface Area (TPSA) | 69.3 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 1 |
| Exact Mass | 174.10045 Da |
| Heavy Atoms | 12 |
| Complexity | 170.0 |
| SMILES | CN1CCC(CC1)(C[N+](=O)[O-])O |
| InChIKey | XIKAWPIDTFYWLQ-UHFFFAOYSA-N |
Chemical Property Profile of 1-Methyl-4-(nitromethyl)piperidin-4-ol
Property Insights of 1-Methyl-4-(nitromethyl)piperidin-4-ol
The XLogP value of 0.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-Methyl-4-(nitromethyl)piperidin-4-ol. The TPSA of 69.3 Ų falls within the moderate polarity range, balancing permeability and solubility for 1-Methyl-4-(nitromethyl)piperidin-4-ol. Following Lipinski's Rule of Five, 1-Methyl-4-(nitromethyl)piperidin-4-ol has 1 hydrogen bond donor(s) and 4 hydrogen bond acceptor(s), all within the drug-like range, suggesting favorable oral bioavailability potential.
Frequently Asked Questions
What is the CAS number of 1-Methyl-4-(nitromethyl)piperidin-4-ol?
The CAS number of 1-Methyl-4-(nitromethyl)piperidin-4-ol is 116250-49-8.
What is the molecular formula of 1-Methyl-4-(nitromethyl)piperidin-4-ol?
The molecular formula of 1-Methyl-4-(nitromethyl)piperidin-4-ol is C7H14N2O3.
What is the molecular weight of 1-Methyl-4-(nitromethyl)piperidin-4-ol?
The molecular weight of 1-Methyl-4-(nitromethyl)piperidin-4-ol is 174.10045 g/mol.
Where can I buy 1-Methyl-4-(nitromethyl)piperidin-4-ol?
You can request a quote for 1-Methyl-4-(nitromethyl)piperidin-4-ol directly from CoreyChem. Contact us or email [email protected] for pricing and availability.
Does CoreyChem offer custom synthesis for 1-Methyl-4-(nitromethyl)piperidin-4-ol?
Yes, CoreyChem provides custom synthesis services for 1-Methyl-4-(nitromethyl)piperidin-4-ol and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.