Basic information
- Standard SMILES
CN(C)c1ccnc(NC2CCN(CCc3ccccc3)CC2)n1- InChIKey
IKNYXRMBLFIVNF-UHFFFAOYSA-N- Molecular formula
- C19H27N5
- Average molar mass
- 325.5 g/mol
- Monoisotopic mass
- 325.22664588
Names & identifiers
- Preferred name
- N4,N4-dimethyl-N2-[1-(2-phenylethyl)-4-piperidinyl]-2,4-pyrimidinediamine
- IUPAC
- 4-N,4-N-dimethyl-2-N-[1-(2-phenylethyl)piperidin-4-yl]pyrimidine-2,4-diamine
Names & synonyms
IKNYXRMBLFIVNF-UHFFFAOYSA-NN4,N4-dimethyl-N2-[1-(2-phenylethyl)-4-piperidinyl]-2,4-pyrimidinediamineN4,N4 -dimethyl-N2 -[1-(2-phenylethyl)-4-piperidinyl]-2,4-pyrimidinediamine
Database identifiers
- PubChem CID
- 53921131
Properties
Computed structural properties
- XLogP
- 3.5
- Topological polar surface area
- 44.3 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 6
- Heavy atoms
- 24
- Formal charge
- 0
- Complexity
- 348
Related reactions
3 records
Linked notes
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