(2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone
TL;DR: (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone (CAS 349084-36-2) is a chemical compound with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
(2-methyl-3-nitrophenyl)-piperidin-1-ylmethanone
Also Known As: 2-methyl-3-nitrophenyl piperidyl ketone, (2-methyl-3-nitrophenyl)(piperidin-1-yl)methanone, (2-methyl-3-nitrophenyl)-piperidin-1-ylmethanone
| Molecular Formula | C13H16N2O3 |
|---|---|
| Molecular Weight | 248.12 g/mol |
| LogP | 2.52932 |
| Topological Polar Surface Area | 63.45 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 248.11609 |
| Heavy Atoms | 18 |
| Complexity | 479.12476 |
Chemical Identifiers
| CAS Number | 349084-36-2 |
|---|---|
| SMILES | CC1=C(C=CC=C1[N+](=O)[O-])C(=O)N2CCCCC2 |
Product Overview
(2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone (CAS 349084-36-2), with molecular formula C13H16N2O3 and molecular weight 248.12 g/mol. IUPAC: (2-methyl-3-nitrophenyl)-piperidin-1-ylmethanone.
Chemical Property Profile of (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone
Property Insights of (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone
The XLogP value of 2.52932 suggests moderate lipophilicity, balancing water solubility and membrane permeability for (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone. The TPSA of 63.45 Ų falls within the moderate polarity range, balancing permeability and solubility for (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone. Following Lipinski's Rule of Five, (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone has 0 hydrogen bond donor(s) and 3 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-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone?
The CAS number of (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone is 349084-36-2.
What is the molecular formula of (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone?
The molecular formula of (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone is C13H16N2O3.
What is the molecular weight of (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone?
The molecular weight of (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone is 248.12 g/mol.
Where can I buy (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone?
You can request a quote for (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone?
Yes, KEHONG BIO provides custom synthesis services for (2-Methyl-3-nitrophenyl)(piperidin-1-yl)methanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.