4-Methyl-2,6-naphthyridine
PubChem CID: 588916
Connections displayed (default: 10).
Loading graph...
| Compound Synonyms | 2,6-Naphthyridine, 4-methyl-, 31121-65-0, 4-Methyl-2,6-naphthyridine, 2,6-Naphthyridine,4-methyl-(8CI,9CI), 4-Methyl-2,6-naphthyridin, SCHEMBL10200876, LLWZYICPFDZZOG-UHFFFAOYSA-N, DB-280997 |
|---|---|
| Ghose Rule | False |
| Classyfire Kingdom | Organic compounds |
| Topological Polar Surface Area | 25.8 |
| Hydrogen Bond Donor Count | 0.0 |
| Pfizer 3 75 Rule | False |
| Scaffold Graph Level | C1CCC2CCCCC2C1 |
| Np Classifier Class | Pyridine alkaloids |
| Deep Smiles | Cccnccc6cncc6 |
| Heavy Atom Count | 11.0 |
| Classyfire Class | Diazanaphthalenes |
| Scaffold Graph Node Level | C1CC2CNCCC2CN1 |
| Classyfire Subclass | Naphthyridines |
| Isotope Atom Count | 0.0 |
| Molecular Complexity | 136.0 |
| Database Name | imppat_phytochem;pubchem |
| Defined Atom Stereocenter Count | 0.0 |
| Iupac Name | 4-methyl-2,6-naphthyridine |
| Veber Rule | True |
| Classyfire Superclass | Organoheterocyclic compounds |
| Xlogp | 1.4 |
| Gsk 4 400 Rule | True |
| Molecular Formula | C9H8N2 |
| Scaffold Graph Node Bond Level | c1cc2cnccc2cn1 |
| Inchi Key | LLWZYICPFDZZOG-UHFFFAOYSA-N |
| Silicos It Class | Soluble |
| Rotatable Bond Count | 0.0 |
| Synonyms | 4-methyl-2,6-naphthyridine |
| Esol Class | Soluble |
| Functional Groups | cnc |
| Compound Name | 4-Methyl-2,6-naphthyridine |
| Exact Mass | 144.069 |
| Formal Charge | 0.0 |
| Monoisotopic Mass | 144.069 |
| Hydrogen Bond Acceptor Count | 2.0 |
| Molecular Weight | 144.17 |
| Gi Absorption | True |
| Covalent Unit Count | 1.0 |
| Total Atom Stereocenter Count | 0.0 |
| Total Bond Stereocenter Count | 0.0 |
| Lipinski Rule Of 5 | True |
| Inchi | InChI=1S/C9H8N2/c1-7-4-11-5-8-2-3-10-6-9(7)8/h2-6H,1H3 |
| Smiles | CC1=CN=CC2=C1C=NC=C2 |
| Np Classifier Biosynthetic Pathway | Alkaloids |
| Defined Bond Stereocenter Count | 0.0 |
| Egan Rule | True |
| Np Classifier Superclass | Nicotinic acid alkaloids |
- 1. Outgoing r'ship
FOUND_INto/from Antirrhinum Majus (Plant) Rel Props:Reference:https://doi.org/10.2174/0929867033456729 - 2. Outgoing r'ship
FOUND_INto/from Misopates Orontium (Plant) Rel Props:Reference:ISBN:9788185042114