Basic information
- Standard SMILES
Cc1nc(NCc2ccccn2)nc(Cl)c1C- InChIKey
XYHROOFURNWQEN-UHFFFAOYSA-N- Molecular formula
- C12H13ClN4
- Average molar mass
- 248.71 g/mol
Names & identifiers
- Preferred name
- 4-chloro-5,6-dimethyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
- IUPAC
- 4-chloro-5,6-dimethyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine
Names & synonyms
1450809-17-24-chloro-5,6-dimethyl-N-(pyridin-2-ylmethyl)pyrimidin-2-amine4-chloro-5,6-dimethyl-N-[(pyridin-2-yl)methyl]pyrimidin-2-amineSCHEMBL15200781XYHROOFURNWQEN-UHFFFAOYSA-NALBB-033905MFCD28129619AKOS021982682DA-39619H47283
Database identifiers
- PubChem CID
- 83290666
Properties
Computed structural properties
- XLogP
- 2.7
- Topological polar surface area
- 50.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 17
- Formal charge
- 0
- Complexity
- 239
Related reactions
3 records
Compound notes
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