2-氰基-N-(1-甲基丙基)乙酰胺
TL;DR: 2-氰基-N-(1-甲基丙基)乙酰胺 (CAS 52493-36-4) is a chemical compound with molecular formula C7H12N2O and molecular weight 140.09 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
2-氰基-N-(1-甲基丙基)乙酰胺
N-butan-2-yl-2-cyanoacetamide
Also Known As: 2-cyano-N- acetamide, 2-Cyano-N-(1-methylpropyl)acetamide, n-sec-butyl-2-cyanoacetamide, n-(sec-butyl)-2-cyanoacetamide, N-butan-2-yl-2-cyanoacetamide
| Molecular Formula | C7H12N2O |
|---|---|
| Molecular Weight | 140.09 g/mol |
| LogP | 0.8 |
| Topological Polar Surface Area | 52.9 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 2 |
| Rotatable Bonds | 3 |
| Exact Mass | 140.09496 |
| Heavy Atoms | 10 |
| Complexity | 156.0 |
Chemical Identifiers
| CAS Number | 52493-36-4 |
|---|---|
| SMILES | CCC(C)NC(=O)CC#N |
| InChIKey | RUUYCRFHVMJFJC-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 2 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
2-氰基-N-(1-甲基丙基)乙酰胺 (CAS 52493-36-4), with molecular formula C7H12N2O and molecular weight 140.09 g/mol. IUPAC: N-butan-2-yl-2-cyanoacetamide.
Chemical Property Profile of 2-氰基-N-(1-甲基丙基)乙酰胺
Property Insights of 2-氰基-N-(1-甲基丙基)乙酰胺
The XLogP value of 0.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 2-氰基-N-(1-甲基丙基)乙酰胺. With a topological polar surface area (TPSA) of 52.9 Ų, 2-氰基-N-(1-甲基丙基)乙酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 2-氰基-N-(1-甲基丙基)乙酰胺 has 1 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 2-氰基-N-(1-甲基丙基)乙酰胺?
The CAS number of 2-氰基-N-(1-甲基丙基)乙酰胺 is 52493-36-4.
What is the molecular formula of 2-氰基-N-(1-甲基丙基)乙酰胺?
The molecular formula of 2-氰基-N-(1-甲基丙基)乙酰胺 is C7H12N2O.
What is the molecular weight of 2-氰基-N-(1-甲基丙基)乙酰胺?
The molecular weight of 2-氰基-N-(1-甲基丙基)乙酰胺 is 140.09 g/mol.
Where can I buy 2-氰基-N-(1-甲基丙基)乙酰胺?
You can request a quote for 2-氰基-N-(1-甲基丙基)乙酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 2-氰基-N-(1-甲基丙基)乙酰胺?
Yes, KEHONG BIO provides custom synthesis services for 2-氰基-N-(1-甲基丙基)乙酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.