Reactant for preparation of: . HIV-1 integrase inhibitors targeting the catalytic domain and its ability for interaction with LEDGF/p75 . Inhibitors of Gli1-mediated transcription in the Hedgehog pathway . SCIO-469-like compounds for the inhibition of p38 MAP kinase . 4-(indol-5-ylamino)thieno[2,3-b]pyridine-5-carbonitriles as protein kinase c theta (PKC θ) inhibitors . Non-covalent thrombin inhibitors
| Pubchem Sid | 488183384 |
|---|---|
| Pubchem Sid Url | https://pubchem.ncbi.nlm.nih.gov/substance/488183384 |
| Canonical Smiles | C1=CC2=C(C=CN2)C=C1CN |
| IUPAC Name | 1H-indol-5-ylmethanamine |
| InChIKey | UAYYSAPJTRVEQA-UHFFFAOYSA-N |
| INCHI | 1S/C9H10N2/c10-6-7-1-2-9-8(5-7)3-4-11-9/h1-5,11H,6,10H2 |
| Isomeric SMILES | C1=CC2=C(C=CN2)C=C1CN |
| WGK Germany | 3 |
| RTECS | NL4461500 |
| Molecular Weight | 146.19 |
| Reaxy-Rn | 6322546 |
| Reaxys-RN_link_address | https://www.reaxys.com/reaxys/secured/hopinto.do?context=S&query=IDE.XRN=6322546&ln= |
Comprehensive hazard, handling, storage, and regulatory compliance document.
Download SDS →Lot-specific quality data. Enter your lot number to retrieve the exact COA.
Look up COA →Full quality attributes and acceptance criteria for this grade.
View spec sheet →Taxonomy Tree
| Kingdom | Organic compounds |
|---|---|
| Superclass | Organoheterocyclic compounds |
| Class | Indoles and derivatives |
| Subclass | Indoles |
| Intermediate Tree Nodes | Not available |
| Direct Parent | Indoles |
| Alternative Parents | Aralkylamines Benzenoids Pyrroles Heteroaromatic compounds Azacyclic compounds Organopnictogen compounds Monoalkylamines Hydrocarbon derivatives |
| Molecular Framework | Aromatic heteropolycyclic compounds |
| Substituents | Indole - Aralkylamine - Benzenoid - Heteroaromatic compound - Pyrrole - Azacycle - Organic nitrogen compound - Organopnictogen compound - Hydrocarbon derivative - Primary amine - Organonitrogen compound - Primary aliphatic amine - Amine - Aromatic heteropolycyclic compound |
| Description | This compound belongs to the class of organic compounds known as indoles. These are compounds containing an indole moiety, which consists of pyrrole ring fused to benzene to form 2,3-benzopyrrole. |
| External Descriptors | Not available |
Find and download the COA for your product by matching the lot number on the packaging.
| Lot Number | Certificate Type | Date | Item |
|---|---|---|---|
 K2229081 | Certificate of Analysis | Jun 09, 2026 | A136890 |
| K2229082 | Certificate of Analysis | Jun 09, 2026 | A136890 |
| K2229083 | Certificate of Analysis | Jun 09, 2026 | A136890 |
| K2229084 | Certificate of Analysis | Jun 09, 2026 | A136890 |
| C2617133 | Certificate of Analysis | Mar 25, 2026 | A136890 |
| C2204085 | Certificate of Analysis | Sep 09, 2025 | A136890 |
| C2306603 | Certificate of Analysis | Dec 06, 2024 | A136890 |
| C2306602 | Certificate of Analysis | Dec 06, 2024 | A136890 |
| C2204127 | Certificate of Analysis | Mar 14, 2022 | A136890 |
| C2204131 | Certificate of Analysis | Mar 14, 2022 | A136890 |
| C2306599 | Certificate of Analysis | Mar 14, 2022 | A136890 |
| Sensitivity | light sensitive |
|---|---|
| Molecular Weight | 146.190 g/mol |
| XLogP3 | 1.200 |
| Hydrogen Bond Donor Count | 2 |
| Hydrogen Bond Acceptor Count | 1 |
| Rotatable Bond Count | 1 |
| Exact Mass | 146.084 Da |
| Monoisotopic Mass | 146.084 Da |
| Topological Polar Surface Area | 41.800 Ų |
| Heavy Atom Count | 11 |
| Formal Charge | 0 |
| Complexity | 136.000 |
| Isotope Atom Count | 0 |
| Defined Atom Stereocenter Count | 0 |
| Undefined Atom Stereocenter Count | 0 |
| Defined Bond Stereocenter Count | 0 |
| Undefined Bond Stereocenter Count | 0 |
| The total count of all stereochemical bonds | 0 |
| Covalently-Bonded Unit Count | 1 |
