[5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone
TL;DR: [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone (CAS 424788-94-3) is a chemical compound with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-methyl-N-(5-oxo-5-pyridin-3-ylpentyl)nitrous amide
Also Known As: [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone|N-methyl-N-(5-oxo-5-pyridin-3-ylpentyl)nitrous amide|5-(METHYLNITROSAMINO)-1-(3-PYRIDYL)-1-PENTANONE|J2.239.438J|5-(Methylnitrosoamino)-1-(3-pyridinyl)-1-pentanone|1-(3-Pyridyl)-5-(methylnitrosoamino)-1-pentanone|N-methyl-N-(5-oxo-5-pyridin-3-yl-pentyl)nitrous Amide|N-Methyl-N-[5-oxo-5-(pyridin-3-yl)pentyl]nitrous amide|5-[METHYL(NITROSO)AMINO]-1-(PYRIDIN-3-YL)PENTAN-1-ONE
| Molecular Formula | C11H15N3O2 |
|---|---|
| Molecular Weight | 221.12 g/mol |
| LogP | 2.0478 |
| Topological Polar Surface Area | 62.63 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 4 |
| Rotatable Bonds | 7 |
| Exact Mass | 221.11642 |
| Heavy Atoms | 16 |
| Complexity | 340.34274 |
Chemical Identifiers
| CAS Number | 424788-94-3 |
|---|---|
| SMILES | CN(CCCCC(=O)C1=CN=CC=C1)N=O |
Product Overview
[5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone (CAS 424788-94-3), with molecular formula C11H15N3O2 and molecular weight 221.12 g/mol. IUPAC: N-methyl-N-(5-oxo-5-pyridin-3-ylpentyl)nitrous amide.
Chemical Property Profile of [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone
Property Insights of [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone
The XLogP value of 2.0478 suggests moderate lipophilicity, balancing water solubility and membrane permeability for [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone. The TPSA of 62.63 Ų falls within the moderate polarity range, balancing permeability and solubility for [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone. Following Lipinski's Rule of Five, [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone has 0 hydrogen bond donor(s) and 4 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 [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone?
The CAS number of [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone is 424788-94-3.
What is the molecular formula of [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone?
The molecular formula of [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone is C11H15N3O2.
What is the molecular weight of [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone?
The molecular weight of [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone is 221.12 g/mol.
Where can I buy [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone?
You can request a quote for [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone?
Yes, KEHONG BIO provides custom synthesis services for [5-(Methylnitrosamino)-1-(3-pyridyl)-1-pentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.