8-Methoxy-2-Methylquinoline
PubChem CID: 316986
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| Compound Synonyms | 8-Methoxy-2-methylquinoline, 3033-80-5, Quinoline, 8-methoxy-2-methyl-, MFCD00034436, DTXSID90311854, 8-Methoxyquinaldine, NSC246071, 8-methoxy-2-methyl-quinoline, SCHEMBL873587, CHEMBL2321989, DTXCID90262978, ALBB-027820, STL384232, AKOS003238594, NSC-246071, SB67474, AS-42378, DB-047762, CS-0102192, M1088, 622-459-1 |
|---|---|
| Topological Polar Surface Area | 22.1 |
| Hydrogen Bond Donor Count | 0.0 |
| Heavy Atom Count | 13.0 |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 171.0 |
| Database Name | cmaup_ingredients;npass_chem_all;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 8-methoxy-2-methylquinoline |
| Prediction Hob | 1.0 |
| Xlogp | 2.7 |
| Molecular Formula | C11H11NO |
| Prediction Swissadme | 0.0 |
| Inchi Key | OQXVXPBDSJQYRR-UHFFFAOYSA-N |
| Fcsp3 | 0.1818181818181818 |
| Logs | -1.782 |
| Rotatable Bond Count | 1.0 |
| Logd | 2.384 |
| Compound Name | 8-Methoxy-2-Methylquinoline |
| Prediction Hob Swissadme | 0.0 |
| Exact Mass | 173.084 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 173.084 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 173.21 |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Esol | -3.092963769230769 |
| Inchi | InChI=1S/C11H11NO/c1-8-6-7-9-4-3-5-10(13-2)11(9)12-8/h3-7H,1-2H3 |
| Smiles | CC1=NC2=C(C=CC=C2OC)C=C1 |
| Nring | 2.0 |
| Defined Bond Stereocenter Count | 0.0 |
- 1. Outgoing r'ship
FOUND_INto/from Tylophora Ovata (Plant) Rel Props:Source_db:cmaup_ingredients;npass_chem_all