Basic information
- Standard SMILES
CN1Cc2c(-c3cnn(CCOC4CCCCO4)c3)ccc(N)c2C1=O- InChIKey
VFMZQFYYQCFWLJ-UHFFFAOYSA-N- Molecular formula
- C19H24N4O3
- Average molar mass
- 356.4 g/mol
Names & identifiers
- Preferred name
- 7-Amino-2-methyl-4-{1-[2-(tetrahydro-2H-pyran-2-yloxy)ethyl]-1H-pyrazol-4-yl}-2,3-dihydro-1H-isoindol-1-one
- IUPAC
- 7-amino-2-methyl-4-[1-[2-(oxan-2-yloxy)ethyl]pyrazol-4-yl]-3H-isoindol-1-one
Names & synonyms
SCHEMBL2033957VFMZQFYYQCFWLJ-UHFFFAOYSA-N7-Amino-2-methyl-4-{1-[2-(tetrahydro-2H-pyran-2-yloxy)ethyl]-1H-pyrazol-4-yl}-2,3-dihydro-1H-isoindol-1-one
Database identifiers
- PubChem CID
- 67255285
Properties
Computed structural properties
- XLogP
- 1.4
- Topological polar surface area
- 82.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 5
- Heavy atoms
- 26
- Formal charge
- 0
- Complexity
- 505
Related reactions
3 records
Compound notes
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