N,3-dimethyl-N-phenylbutanamide
TL;DR: N,3-dimethyl-N-phenylbutanamide (CAS 150982-96-0) is a chemical compound with molecular formula C12H17NO and molecular weight 191.13 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N,3-dimethyl-N-phenylbutanamide
Also Known As: N-methyl-isovaleranilide, N,3-dimethyl-N-phenylbutanamide, NCIOpen2_001755
| Molecular Formula | C12H17NO |
|---|---|
| Molecular Weight | 191.13 g/mol |
| LogP | 2.4 |
| Topological Polar Surface Area | 20.3 Ų |
| Hydrogen Bond Donors | 0 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 191.13101 |
| Heavy Atoms | 14 |
| Complexity | 183.0 |
Chemical Identifiers
| CAS Number | 150982-96-0 |
|---|---|
| SMILES | CC(C)CC(=O)N(C)C1=CC=CC=C1 |
| InChIKey | YLXIWSXSEAJEMI-UHFFFAOYSA-N |
Product Overview
N,3-dimethyl-N-phenylbutanamide (CAS 150982-96-0), with molecular formula C12H17NO and molecular weight 191.13 g/mol. IUPAC: N,3-dimethyl-N-phenylbutanamide.
Chemical Property Profile of N,3-dimethyl-N-phenylbutanamide
Property Insights of N,3-dimethyl-N-phenylbutanamide
The XLogP value of 2.4 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N,3-dimethyl-N-phenylbutanamide. With a topological polar surface area (TPSA) of 20.3 Ų, N,3-dimethyl-N-phenylbutanamide exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N,3-dimethyl-N-phenylbutanamide has 0 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,3-dimethyl-N-phenylbutanamide?
The CAS number of N,3-dimethyl-N-phenylbutanamide is 150982-96-0.
What is the molecular formula of N,3-dimethyl-N-phenylbutanamide?
The molecular formula of N,3-dimethyl-N-phenylbutanamide is C12H17NO.
What is the molecular weight of N,3-dimethyl-N-phenylbutanamide?
The molecular weight of N,3-dimethyl-N-phenylbutanamide is 191.13 g/mol.
Where can I buy N,3-dimethyl-N-phenylbutanamide?
You can request a quote for N,3-dimethyl-N-phenylbutanamide directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N,3-dimethyl-N-phenylbutanamide?
Yes, KEHONG BIO provides custom synthesis services for N,3-dimethyl-N-phenylbutanamide and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.