Basic information
- Standard SMILES
Nc1nc(N)c(CCCc2cccc3ccccc23)c(N)n1- InChIKey
MZILJZMZCKWMJD-UHFFFAOYSA-N- Molecular formula
- C17H19N5
- Average molar mass
- 293.4 g/mol
Names & identifiers
- Preferred name
- 2,4,6-Triamino-5-[3-(naphth-1-yl)propyl]pyrimidine
- IUPAC
- 5-(3-naphthalen-1-ylpropyl)pyrimidine-2,4,6-triamine
Names & synonyms
SCHEMBL8901982MZILJZMZCKWMJD-UHFFFAOYSA-N2,4,6-triamino-5-[3-(naphth-1-yl)propyl]pyrimidine
Database identifiers
- PubChem CID
- 19955501
Properties
Computed structural properties
- XLogP
- 3.2
- Topological polar surface area
- 104 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 338
Related reactions
3 records
Compound notes
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