4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline
Basic information
- CAS
25187-68-2- Standard SMILES
Cc1ccc(NCC2CNc3ccccc3N2)cc1- InChIKey
GEGCIRNHHQBIJJ-UHFFFAOYSA-N- Molecular formula
- C16H19N3
- Average molar mass
- 253.34 g/mol
- Monoisotopic mass
- 253.15789762
Names & identifiers
- Preferred name
- 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline
- IUPAC
- 4-methyl-N-(1,2,3,4-tetrahydroquinoxalin-2-ylmethyl)aniline
Names & synonyms
NSC12334425187-68-2NSC-123344
Database identifiers
- CAS
25187-68-2- PubChem CID
- 276102
Properties
Computed structural properties
- XLogP
- 3.8
- Topological polar surface area
- 36.1 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 273
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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