Basic information
- Standard SMILES
c1ccc2c(NC[C@@H]3CCCCN3)ncnc2c1- InChIKey
VROAABFFLYBWSX-NSHDSACASA-N- Molecular formula
- C14H18N4
- Average molar mass
- 242.32 g/mol
Names & identifiers
- Preferred name
- (S)-2-(Quinazolin-4-ylaminomethyl)-piperidine
- IUPAC
- N-[[(2S)-piperidin-2-yl]methyl]quinazolin-4-amine
Names & synonyms
SCHEMBL1598457VROAABFFLYBWSX-NSHDSACASA-N(S)-2-(Quinazolin4-ylaminomethyl)-piperidine(S)-2-(Quinazolin-4-ylaminomethyl)-piperidine
Database identifiers
- PubChem CID
- 67090678
Properties
Computed structural properties
- XLogP
- 2.9
- Topological polar surface area
- 49.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 18
- Formal charge
- 0
- Complexity
- 258
Related reactions
3 records
Compound notes
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