N-乙酰基色胺
TL;DR: N-乙酰基色胺 (CAS 1016-47-3) is a chemical compound with molecular formula C12H14N2O and molecular weight 202.11 g/mol, supplied by Kehong Biological (Henan Kehong Biological Technology Co., Ltd.) with CRO/CDMO custom synthesis services.
N-乙酰基色胺
N-[2-(1H-indol-3-yl)ethyl]acetamide
Also Known As: N-Acetyltryptamine, Acetotryptamide, N-(2-(1H-indol-3-yl)ethyl)acetamide, N-[2-(1H-Indol-3-yl)ethyl]acetamide, Nb-acetyltryptamine
| Molecular Formula | C12H14N2O |
|---|---|
| Molecular Weight | 202.11 g/mol |
| LogP | 1.8 |
| Topological Polar Surface Area | 44.9 Ų |
| Hydrogen Bond Donors | 2 |
| Hydrogen Bond Acceptors | 1 |
| Rotatable Bonds | 3 |
| Exact Mass | 202.11061 |
| Heavy Atoms | 15 |
| Complexity | 230.0 |
Chemical Identifiers
| CAS Number | 1016-47-3 |
|---|---|
| SMILES | CC(=O)NCCC1=CNC2=CC=CC=C21 |
| InChIKey | NVUGEQAEQJTCIX-UHFFFAOYSA-N |
Patent-Derived Application Labels
Derived from 5 IPC patent classification(s) across the SureChEMBL global patent database.
Product Overview
N-乙酰基色胺 (CAS 1016-47-3), with molecular formula C12H14N2O and molecular weight 202.11 g/mol. IUPAC: N-[2-(1H-indol-3-yl)ethyl]acetamide.
Chemical Property Profile of N-乙酰基色胺
Property Insights of N-乙酰基色胺
The XLogP value of 1.8 suggests moderate lipophilicity, balancing water solubility and membrane permeability for N-乙酰基色胺. With a topological polar surface area (TPSA) of 44.9 Ų, N-乙酰基色胺 exhibits relatively low polarity, potentially indicating favorable cell membrane permeability. Following Lipinski's Rule of Five, N-乙酰基色胺 has 2 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-乙酰基色胺?
The CAS number of N-乙酰基色胺 is 1016-47-3.
What is the molecular formula of N-乙酰基色胺?
The molecular formula of N-乙酰基色胺 is C12H14N2O.
What is the molecular weight of N-乙酰基色胺?
The molecular weight of N-乙酰基色胺 is 202.11 g/mol.
Where can I buy N-乙酰基色胺?
You can request a quote for N-乙酰基色胺 directly from KEHONG BIO. Contact us or email info@kehongbio.com for pricing and availability.
Does KEHONG BIO offer custom synthesis for N-乙酰基色胺?
Yes, KEHONG BIO provides custom synthesis services for N-乙酰基色胺 and related compounds. Contact us with your specific requirements including quantity, purity, and timeline.