Basic information
- Standard SMILES
CC(C)N1CCC(Oc2ccc3[nH]c(C(=O)O)cc3c2)CC1- InChIKey
ZRIYKSMFARHXFO-UHFFFAOYSA-N- Molecular formula
- C17H22N2O3
- Average molar mass
- 302.37 g/mol
Names & identifiers
- Preferred name
- 5-(1-isopropyl-piperidin-4-yloxy)-1H-indole-2-carboxylic acid
- IUPAC
- 5-(1-propan-2-ylpiperidin-4-yl)oxy-1H-indole-2-carboxylic acid
Names & synonyms
SCHEMBL3243347ZRIYKSMFARHXFO-UHFFFAOYSA-N5-(1-isopropyl-piperidin-4-yloxy)-1H-indole-2-carboxylic acid5-[[1-(1-methylethyl)-4-piperidinyl]oxy]-1H-Indole-2-carboxylic acid
Database identifiers
- PubChem CID
- 59699456
Properties
Computed structural properties
- XLogP
- 1
- Topological polar surface area
- 65.6 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 4
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 393
Related reactions
6 records
Compound notes
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