RYP
~{N}-methyl-1-pyridin-4-yl-methanamine
Created: | 2020-03-02 |
Last modified: | 2020-04-22 |
Find Related PDB Entry |
---|
Find related ligands: |
---|
Chemical Details | |
---|---|
Formal Charge | 0 |
Atom Count | 19 |
Chiral Atom Count | 0 |
Bond Count | 19 |
Aromatic Bond Count | 6 |
Chemical Component Summary | |
---|---|
Name | ~{N}-methyl-1-pyridin-4-yl-methanamine |
Systematic Name (OpenEye OEToolkits) | ~{N}-methyl-1-pyridin-4-yl-methanamine |
Formula | C7 H10 N2 |
Molecular Weight | 122.168 |
Type | NON-POLYMER |
Chemical Descriptors | |||
---|---|---|---|
Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CNCc1ccncc1 |
SMILES | OpenEye OEToolkits | 2.0.6 | CNCc1ccncc1 |
Canonical SMILES | CACTVS | 3.385 | CNCc1ccncc1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.6 | CNCc1ccncc1 |
InChI | InChI | 1.03 | InChI=1S/C7H10N2/c1-8-6-7-2-4-9-5-3-7/h2-5,8H,6H2,1H3 |
InChIKey | InChI | 1.03 | DNBWGFKLIBQQSL-UHFFFAOYSA-N |
Related Resource References
Resource Name | Reference |
---|---|
PubChem | 81436 |