Heptanamide, 2-ethyl-
TL;DR: Heptanamide, 2-ethyl- (CAS 4164-94-7) is a chemical compound with molecular formula C9H19NO and molecular weight 157.15 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-ethylheptanamide
Also Known As: 2-Ethylheptanamide, HEPTANAMIDE, 2-ETHYL-, 4-02-00-01029 (Beilstein Handbook Reference), J3.159.764A, RefChem:1086429
| Molecular Formula | C9H19NO |
|---|---|
| Molecular Weight | 157.15 g/mol |
| LogP | 2.5 |
| Topological Polar Surface Area | 43.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 6 |
| Exact Mass | 157.14667 |
| Heavy Atoms | 11 |
| Complexity | 112.0 |
Chemical Identifiers
| CAS Number | 4164-94-7 |
|---|---|
| SMILES | CCCCCC(CC)C(=O)N |
| InChIKey | AOFZLQPFVNKHSR-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
Heptanamide, 2-ethyl- (CAS 4164-94-7), with molecular formula C9H19NO and molecular weight 157.15 g/mol. IUPAC: 2-ethylheptanamide.
Chemical Property Profile of Heptanamide, 2-ethyl-
Property Insights of Heptanamide, 2-ethyl-
The XLogP value of 2.5 suggests moderate lipophilicity, balancing water solubility and membrane permeability for Heptanamide, 2-ethyl-. With a topological polar surface area (TPSA) of 43.1 Ų, Heptanamide, 2-ethyl- exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, Heptanamide, 2-ethyl- 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 Heptanamide, 2-ethyl-?
The CAS number of Heptanamide, 2-ethyl- is 4164-94-7.
What is the molecular formula of Heptanamide, 2-ethyl-?
The molecular formula of Heptanamide, 2-ethyl- is C9H19NO.
What is the molecular weight of Heptanamide, 2-ethyl-?
The molecular weight of Heptanamide, 2-ethyl- is 157.15 g/mol.
Where can I buy Heptanamide, 2-ethyl-?
You can request a quote for Heptanamide, 2-ethyl- directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for Heptanamide, 2-ethyl-?
Yes, KEHONG BIO provides custom synthesis services for Heptanamide, 2-ethyl- and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.