N-Pentan-2-ylformamide
TL;DR: N-Pentan-2-ylformamide (CAS 59734-19-9) is a chemical compound with molecular formula C6H13NO and molecular weight 115.10 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-pentan-2-ylformamide
Also Known As: N-pentan-2-ylformamide, N-(pentan-2-yl)formamide, RefChem:364714
| Molecular Formula | C6H13NO |
|---|---|
| Molecular Weight | 115.10 g/mol |
| LogP | 1.2 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 115.09972 |
| Heavy Atoms | 8 |
| Complexity | 63.0 |
Chemical Identifiers
| CAS Number | 59734-19-9 |
|---|---|
| SMILES | CCCC(C)NC=O |
| InChIKey | IHZXGJVLQCGKCB-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 12 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-Pentan-2-ylformamide (CAS 59734-19-9), with molecular formula C6H13NO and molecular weight 115.10 g/mol. IUPAC: N-pentan-2-ylformamide.
Chemical Property Profile of N-Pentan-2-ylformamide
Property Insights of N-Pentan-2-ylformamide
The XLogP value of 1.2 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-Pentan-2-ylformamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-Pentan-2-ylformamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-Pentan-2-ylformamide has 1 hydrogen bond donor(s) and 1 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-Pentan-2-ylformamide?
The CAS number of N-Pentan-2-ylformamide is 59734-19-9.
What is the molecular formula of N-Pentan-2-ylformamide?
The molecular formula of N-Pentan-2-ylformamide is C6H13NO.
What is the molecular weight of N-Pentan-2-ylformamide?
The molecular weight of N-Pentan-2-ylformamide is 115.10 g/mol.
Where can I buy N-Pentan-2-ylformamide?
You can request a quote for N-Pentan-2-ylformamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-Pentan-2-ylformamide?
Yes, KEHONG BIO provides custom synthesis services for N-Pentan-2-ylformamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.