Basic information
- Standard SMILES
Cc1nc(NCc2ccccn2)nc(NC2CCOCC2)c1C- InChIKey
UGTFZEGPCPXYKI-UHFFFAOYSA-N- Molecular formula
- C17H23N5O
- Average molar mass
- 313.4 g/mol
Names & identifiers
- Preferred name
- 5,6-dimethyl-N2-(pyridin-2-ylmethyl)-N4-(tetrahydro-2H-pyran-4-yl)pyrimidine-2,4-diamine
- IUPAC
- 5,6-dimethyl-4-N-(oxan-4-yl)-2-N-(pyridin-2-ylmethyl)pyrimidine-2,4-diamine
Names & synonyms
SCHEMBL16393668UGTFZEGPCPXYKI-UHFFFAOYSA-N5,6-dimethyl-N2-(pyridin-2-ylmethyl)-N4-(tetrahydro-2H-pyran-4-yl)pyrimidine-2,4-diamine
Database identifiers
- PubChem CID
- 71737959
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 72 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 6
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 350
Related reactions
1 records
Linked notes
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