6-(pentylamino)-1H-pyrimidin-2-one
TL;DR: 6-(pentylamino)-1H-pyrimidin-2-one (CAS 60722-59-0) is a chemical compound with molecular formula C9H15N3O and molecular weight 181.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
6-(pentylamino)-1H-pyrimidin-2-one
Also Known As: 6-(pentylamino)-1H-pyrimidin-2-one, 6-(Pentylamino)pyrimidin-2(1H)-one
| Molecular Formula | C9H15N3O |
|---|---|
| Molecular Weight | 181.12 g/mol |
| LogP | 1.3 |
| Topological Polar Surface Area | 53.5 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 5 |
| Exact Mass | 181.1215 |
| Heavy Atoms | 13 |
| Complexity | 233.0 |
Chemical Identifiers
| CAS Number | 60722-59-0 |
|---|---|
| SMILES | CCCCCNC1=CC=NC(=O)N1 |
| InChIKey | DRPIQFDRESLRIZ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 3 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
6-(pentylamino)-1H-pyrimidin-2-one (CAS 60722-59-0), with molecular formula C9H15N3O and molecular weight 181.12 g/mol. IUPAC: 6-(pentylamino)-1H-pyrimidin-2-one.
Chemical Property Profile of 6-(pentylamino)-1H-pyrimidin-2-one
Property Insights of 6-(pentylamino)-1H-pyrimidin-2-one
The XLogP value of 1.3 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 6-(pentylamino)-1H-pyrimidin-2-one. With a topological polar surface area (TPSA) of 53.5 Ų, 6-(pentylamino)-1H-pyrimidin-2-one exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 6-(pentylamino)-1H-pyrimidin-2-one has 2 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 6-(pentylamino)-1H-pyrimidin-2-one?
The CAS number of 6-(pentylamino)-1H-pyrimidin-2-one is 60722-59-0.
What is the molecular formula of 6-(pentylamino)-1H-pyrimidin-2-one?
The molecular formula of 6-(pentylamino)-1H-pyrimidin-2-one is C9H15N3O.
What is the molecular weight of 6-(pentylamino)-1H-pyrimidin-2-one?
The molecular weight of 6-(pentylamino)-1H-pyrimidin-2-one is 181.12 g/mol.
Where can I buy 6-(pentylamino)-1H-pyrimidin-2-one?
You can request a quote for 6-(pentylamino)-1H-pyrimidin-2-one directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 6-(pentylamino)-1H-pyrimidin-2-one?
Yes, KEHONG BIO provides custom synthesis services for 6-(pentylamino)-1H-pyrimidin-2-one and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.