Basic information
- CAS
685079-15-6- Standard SMILES
C[n+]1cccc2c(N)cccc21- InChIKey
ZMJBCEIHNOWCMC-UHFFFAOYSA-O- Molecular formula
- C10H11N2+
- Average molar mass
- 159.21 g/mol
- Monoisotopic mass
- 159.09222336
Names & identifiers
- Preferred name
- 5-Amino-1-methylquinolinium
- IUPAC
- 1-methylquinolin-1-ium-5-amine
Names & synonyms
5-amino-1-methylquinolinium685079-15-65-AMINO-1-METHYLQUINOLIN-1-IUMPMX593N4N3SCHEMBL6403148SCHEMBL9331979CHEMBL41168285-Amino-1-methylquinolinium ionQuinolinium, 5-amino-1-methyl-ZMJBCEIHNOWCMC-UHFFFAOYSA-OSTL196667AKOS025269993
Database identifiers
- CAS
685079-15-6- PubChem CID
- 950107
- ChEMBL
CHEMBL4116828- UNII
- PMX593N4N3
Properties
Computed structural properties
- XLogP
- 1.1
- Topological polar surface area
- 29.9 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 0
- Heavy atoms
- 12
- Formal charge
- 1
- Complexity
- 158
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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