Basic information
- Standard SMILES
Nc1ncc(CN2CC=C(c3ccccc3)CC2)c(N)n1- InChIKey
VZEMFZCAIOOGBX-UHFFFAOYSA-N- Molecular formula
- C16H19N5
- Average molar mass
- 281.36 g/mol
Names & identifiers
- Preferred name
- 5-(4-phenyl-3,6-dihydro-2H-pyridin-1-ylmethyl)-pyrimidine-2,4-diamine
- IUPAC
- 5-[(4-phenyl-3,6-dihydro-2H-pyridin-1-yl)methyl]pyrimidine-2,4-diamine
Names & synonyms
SCHEMBL7808625VZEMFZCAIOOGBX-UHFFFAOYSA-N5-(4-phenyl-3,6-dihydro-2H-pyridin-1-ylmethyl)-pyrimidine-2,4-diamine
Database identifiers
- PubChem CID
- 21473616
Properties
Computed structural properties
- XLogP
- 1.2
- Topological polar surface area
- 81.1 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 364
Related reactions
2 records
Compound notes
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