1LM
Summary
Name: | quinolin-4-amine |
Formula: | C9 H8 N2 |
Formal charge: | 0 |
Formula weight: | 144.173 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
ACDLabs | 12.01 | quinolin-4-amine |
OpenEye OEToolkits | 1.7.6 | quinolin-4-amine |
Chemical Descriptors
Type | Program | Version | Descriptor |
SMILES | ACDLabs | 12.01 | n1ccc(c2ccccc12)N |
InChI | InChI | 1.03 | InChI=1S/C9H8N2/c10-8-5-6-11-9-4-2-1-3-7(8)9/h1-6H,(H2,10,11) |
InChIKey | InChI | 1.03 | FQYRLEXKXQRZDH-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.370 | Nc1ccnc2ccccc12 |
SMILES | CACTVS | 3.370 | Nc1ccnc2ccccc12 |
SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)c(ccn2)N |
SMILES | OpenEye OEToolkits | 1.7.6 | c1ccc2c(c1)c(ccn2)N |