Basic information
- CAS
629629-40-9- Standard SMILES
Cc1cc(N)c2cc(NC(=O)CCN)ccc2n1- InChIKey
XQWVTOGWJPCRKT-UHFFFAOYSA-N- Molecular formula
- C13H16N4O
- Average molar mass
- 244.29 g/mol
- Monoisotopic mass
- 244.13241113
Names & identifiers
- Preferred name
- 3-Amino-N-(4-amino-2-methyl-quinolin-6-yl)-propionamide
- IUPAC
- 3-amino-N-(4-amino-2-methylquinolin-6-yl)propanamide
Names & synonyms
629629-40-9SCHEMBL32384463-Amino-N-(4-amino-2-methyl-quinolin-6-yl)-propionamideDTXSID00591387XQWVTOGWJPCRKT-UHFFFAOYSA-NN-(4-Amino-2-methylquinolin-6-yl)-beta-alaninamide
Database identifiers
- CAS
629629-40-9- PubChem CID
- 17864629
- DTXSID
DTXSID00591387
Properties
Computed structural properties
- XLogP
- 0.6
- Topological polar surface area
- 94 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 297
Related reactions
5 records
Compound notes
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