3-Methyl-1H-Indole
Representations & DB's id
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| ChEBI: | CHEBI:9171 | |
|---|---|---|
| ChEMBL: | CHEMBL1329793 | |
| PubChem: | 6736 | |
| IUPAC: | 3-methyl-1H-indole | |
| Standard InChI: | InChI=1S/C9H9N/c1-7-6-10-9-5-3-2-4-8(7)9/h2-6,10H,1H3 | |
| Standard InChI Key: | ZFRKQXVRDFCRJG-UHFFFAOYSA-N | |
| SMILES: | Cc1c[nH]c2c1cccc2 | |
Molecular propeties
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| AlogP: | 2.48 | |
|---|---|---|
| Hydrogen bonds acceptors: | 0 | |
| Hydrogen bonds donors: | 1 | |
| Rotatable bonds: | 0 | |
| Number of rings: | 2 | |
| Molecular Weight: | 131.07 | |
| Topological polar surface area: | 15.8 | |
| Number of aromatic rings: | 2 | |
| Fsp3: | 0.111 | |
| Number of carbons: | 9 | |