N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine
TL;DR: N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine (CAS 5765-62-8) is a chemical compound with molecular formula C13H17N3O2 and molecular weight 247.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-1-(4-nitrophenyl)-1-piperidin-1-ylmethanimine
Also Known As: N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine, (1E)-1-(4-nitrophenyl)-1-piperidyl-2-azaprop-1-ene, N-methyl-1-(4-nitrophenyl)-1-(1-piperidyl)methanimine, N-methyl-1-(4-nitrophenyl)-1-piperidin-1-ylmethanimine, (Z)-N-Methyl-1-(4-nitrophenyl)-1-(piperidin-1-yl)methanimine
| Molecular Formula | C13H17N3O2 |
|---|---|
| Molecular Weight | 247.13 g/mol |
| LogP | 2.2 |
| Topological Polar Surface Area | 61.4 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 3 |
| Rotatable Bonds | 2 |
| Exact Mass | 247.13208 |
| Heavy Atoms | 18 |
| Complexity | 311.0 |
Chemical Identifiers
| CAS Number | 5765-62-8 |
|---|---|
| SMILES | CN=C(C1=CC=C(C=C1)[N+](=O)[O-])N2CCCCC2 |
| InChIKey | OTPAPTCLOVFKSV-UHFFFAOYSA-N |
Product Overview
N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine (CAS 5765-62-8), with molecular formula C13H17N3O2 and molecular weight 247.13 g/mol. IUPAC: N-methyl-1-(4-nitrophenyl)-1-piperidin-1-ylmethanimine.
Chemical Property Profile of N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine
Property Insights of N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine
The XLogP value of 2.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine. The TPSA of 61.4 Ų falls within the moderate polarity range, balancing permeability and solubility for N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine. Following Lipinski's Rule of Five, N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine 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 N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine?
The CAS number of N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine is 5765-62-8.
What is the molecular formula of N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine?
The molecular formula of N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine is C13H17N3O2.
What is the molecular weight of N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine?
The molecular weight of N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine is 247.13 g/mol.
Where can I buy N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine?
You can request a quote for N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine?
Yes, KEHONG BIO provides custom synthesis services for N-[(4-nitrophenyl)(1-piperidinyl)methylene]methanamine and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.