N-(1,1-Dimethyl-2-phenylethyl)formamide
TL;DR: N-(1,1-Dimethyl-2-phenylethyl)formamide (CAS 52117-13-2) is a chemical compound with molecular formula C11H15NO and molecular weight 177.12 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-(2-methyl-1-phenylpropan-2-yl)formamide
Also Known As: a,a-Dimethylphenethylformamide, n-(2-methyl-1-phenylpropan-2-yl)formamide, N-(alpha,alpha-Dimethylphenethyl)formamide, starbld0011804, A-Dimethylphenethylformamide
| Molecular Formula | C11H15NO |
|---|---|
| Molecular Weight | 177.12 g/mol |
| LogP | 2.1 |
| Topological Polar Surface Area | 29.1 Ų |
| Hydrogen Bond Donors | 1 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 177.11537 |
| Heavy Atoms | 13 |
| Complexity | 159.0 |
Chemical Identifiers
| CAS Number | 52117-13-2 |
|---|---|
| SMILES | CC(C)(CC1=CC=CC=C1)NC=O |
| InChIKey | VDURGCJDOKTFHJ-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 6 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-(1,1-Dimethyl-2-phenylethyl)formamide (CAS 52117-13-2), with molecular formula C11H15NO and molecular weight 177.12 g/mol. IUPAC: N-(2-methyl-1-phenylpropan-2-yl)formamide.
Chemical Property Profile of N-(1,1-Dimethyl-2-phenylethyl)formamide
Property Insights of N-(1,1-Dimethyl-2-phenylethyl)formamide
The XLogP value of 2.1 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-(1,1-Dimethyl-2-phenylethyl)formamide. With a topological polar surface area (TPSA) of 29.1 Ų, N-(1,1-Dimethyl-2-phenylethyl)formamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-(1,1-Dimethyl-2-phenylethyl)formamide 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-(1,1-Dimethyl-2-phenylethyl)formamide?
The CAS number of N-(1,1-Dimethyl-2-phenylethyl)formamide is 52117-13-2.
What is the molecular formula of N-(1,1-Dimethyl-2-phenylethyl)formamide?
The molecular formula of N-(1,1-Dimethyl-2-phenylethyl)formamide is C11H15NO.
What is the molecular weight of N-(1,1-Dimethyl-2-phenylethyl)formamide?
The molecular weight of N-(1,1-Dimethyl-2-phenylethyl)formamide is 177.12 g/mol.
Where can I buy N-(1,1-Dimethyl-2-phenylethyl)formamide?
You can request a quote for N-(1,1-Dimethyl-2-phenylethyl)formamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-(1,1-Dimethyl-2-phenylethyl)formamide?
Yes, KEHONG BIO provides custom synthesis services for N-(1,1-Dimethyl-2-phenylethyl)formamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.