1-(4-Pyridinyl)-1-pentanone
TL;DR: 1-(4-Pyridinyl)-1-pentanone (CAS 1701-73-1) is a chemical compound with molecular formula C10H13NO and molecular weight 163.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
1-pyridin-4-ylpentan-1-one
Also Known As: 1-(Pyridin-4-yl)pentan-1-one, 4-Valerylpyridine, Butyl 4-pyridyl ketone, Pyridine, 4-valeryl-, 1-pyridin-4-ylpentan-1-one
| Molecular Formula | C10H13NO |
|---|---|
| Molecular Weight | 163.10 g/mol |
| LogP | 1.7 |
| Topological Polar Surface Area | 30.0 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 4 |
| Exact Mass | 163.09972 |
| Heavy Atoms | 12 |
| Complexity | 139.0 |
Chemical Identifiers
| CAS Number | 1701-73-1 |
|---|---|
| SMILES | CCCCC(=O)C1=CC=NC=C1 |
| InChIKey | AZZKIOQLDYOUSM-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
1-(4-Pyridinyl)-1-pentanone (CAS 1701-73-1), with molecular formula C10H13NO and molecular weight 163.10 g/mol. IUPAC: 1-pyridin-4-ylpentan-1-one.
Chemical Property Profile of 1-(4-Pyridinyl)-1-pentanone
Property Insights of 1-(4-Pyridinyl)-1-pentanone
The XLogP value of 1.7 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 1-(4-Pyridinyl)-1-pentanone. With a topological polar surface area (TPSA) of 30.0 Ų, 1-(4-Pyridinyl)-1-pentanone exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 1-(4-Pyridinyl)-1-pentanone 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 1-(4-Pyridinyl)-1-pentanone?
The CAS number of 1-(4-Pyridinyl)-1-pentanone is 1701-73-1.
What is the molecular formula of 1-(4-Pyridinyl)-1-pentanone?
The molecular formula of 1-(4-Pyridinyl)-1-pentanone is C10H13NO.
What is the molecular weight of 1-(4-Pyridinyl)-1-pentanone?
The molecular weight of 1-(4-Pyridinyl)-1-pentanone is 163.10 g/mol.
Where can I buy 1-(4-Pyridinyl)-1-pentanone?
You can request a quote for 1-(4-Pyridinyl)-1-pentanone directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 1-(4-Pyridinyl)-1-pentanone?
Yes, KEHONG BIO provides custom synthesis services for 1-(4-Pyridinyl)-1-pentanone and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.