Basic information
- Standard SMILES
COC(=O)Cc1ccc(-c2nccnc2C2CC2)cc1- InChIKey
KMJXCQLLHJHDOE-UHFFFAOYSA-N- Molecular formula
- C16H16N2O2
- Average molar mass
- 268.31 g/mol
Names & identifiers
- Preferred name
- Methyl [4-(3-cyclopropylpyrazin-2-yl)phenyl]acetate
- IUPAC
- methyl 2-[4-(3-cyclopropylpyrazin-2-yl)phenyl]acetate
Names & synonyms
1146395-36-9SCHEMBL8060302KMJXCQLLHJHDOE-UHFFFAOYSA-NDA-15282methyl [4-(3-cyclopropylpyrazin-2-yl)phenyl]acetate
Database identifiers
- PubChem CID
- 59535940
Properties
Computed structural properties
- XLogP
- 1.8
- Topological polar surface area
- 52.1 Ų
- Hydrogen bond donors
- 0
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 20
- Formal charge
- 0
- Complexity
- 335
Related reactions
2 records
Compound notes
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