3-甲基-N-(2-甲基丙基)丁酰胺
TL;DR: 3-甲基-N-(2-甲基丙基)丁酰胺 (CAS 122348-74-7) 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.
3-甲基-N-(2-甲基丙基)丁酰胺
3-methyl-N-(2-methylpropyl)butanamide
Also Known As: 3-methyl-N-(2-methylpropyl)butanamide, N,N-Diethyl-1-pentyn-3-amine, Butanamide, N-isobutyl-3-methyl, 3-(N,N-Diethylamine)pent-1-yne
| Molecular Formula | C9H19NO |
|---|---|
| Molecular Weight | 157.15 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 4 |
| Exact Mass | 157.14667 |
| Heavy Atoms | 11 |
| Complexity | 119.0 |
Chemical Identifiers
| CAS Number | 122348-74-7 |
|---|---|
| SMILES | CC(C)CC(=O)NCC(C)C |
| InChIKey | BPDCZYLPNNLOBD-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
3-甲基-N-(2-甲基丙基)丁酰胺 (CAS 122348-74-7), with molecular formula C9H19NO and molecular weight 157.15 g/mol. IUPAC: 3-methyl-N-(2-methylpropyl)butanamide.
Chemical Property Profile of 3-甲基-N-(2-甲基丙基)丁酰胺
Property Insights of 3-甲基-N-(2-甲基丙基)丁酰胺
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for 3-甲基-N-(2-甲基丙基)丁酰胺. With a topological polar surface area (TPSA) of 29.1 Ų, 3-甲基-N-(2-甲基丙基)丁酰胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, 3-甲基-N-(2-甲基丙基)丁酰胺 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 3-甲基-N-(2-甲基丙基)丁酰胺?
The CAS number of 3-甲基-N-(2-甲基丙基)丁酰胺 is 122348-74-7.
What is the molecular formula of 3-甲基-N-(2-甲基丙基)丁酰胺?
The molecular formula of 3-甲基-N-(2-甲基丙基)丁酰胺 is C9H19NO.
What is the molecular weight of 3-甲基-N-(2-甲基丙基)丁酰胺?
The molecular weight of 3-甲基-N-(2-甲基丙基)丁酰胺 is 157.15 g/mol.
Where can I buy 3-甲基-N-(2-甲基丙基)丁酰胺?
You can request a quote for 3-甲基-N-(2-甲基丙基)丁酰胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for 3-甲基-N-(2-甲基丙基)丁酰胺?
Yes, KEHONG BIO provides custom synthesis services for 3-甲基-N-(2-甲基丙基)丁酰胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.