Basic information
- Standard SMILES
CC(C)CNC1CCC(Nc2ccc3[nH]ncc3c2)CC1- InChIKey
MDNNZQYQLLHUJI-UHFFFAOYSA-N- Molecular formula
- C17H26N4
- Average molar mass
- 286.4 g/mol
Names & identifiers
- Preferred name
- N1-(1H-5-Indazolyl)-N4-isobutyl-1,4-cyclohexanediamine
- IUPAC
- 4-N-(1H-indazol-5-yl)-1-N-(2-methylpropyl)cyclohexane-1,4-diamine
Names & synonyms
SCHEMBL1716100SCHEMBL14514424SCHEMBL14514425MDNNZQYQLLHUJI-UHFFFAOYSA-NN1-(1H-5-Indazolyl)-N4-isobutyl-1,4-cyclohexanediamine
Database identifiers
- PubChem CID
- 17838119
Properties
Computed structural properties
- XLogP
- 4.4
- Topological polar surface area
- 52.7 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 312
Related reactions
2 records
Compound notes
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