Basic information
- Standard SMILES
Cc1nn(C2CCCC2)c2nc(C3CC3)cc(C(=O)O)c12- InChIKey
UQRGISZTLGTEQP-UHFFFAOYSA-N- Molecular formula
- C16H19N3O2
- Average molar mass
- 285.34 g/mol
Names & identifiers
- Preferred name
- 1-Cyclopentyl-6-cyclopropyl-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
- IUPAC
- 1-cyclopentyl-6-cyclopropyl-3-methylpyrazolo[5,4-b]pyridine-4-carboxylic acid
Names & synonyms
SCHEMBL1694786UQRGISZTLGTEQP-UHFFFAOYSA-N1-Cyclopentyl-6-cyclopropyl-3-methyl-1H-pyrazolo[3,4-b]pyridine-4-carboxylic acid
Database identifiers
- PubChem CID
- 67124183
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 68 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 3
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 420
Related reactions
4 records
Compound notes
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