Basic information
- Standard SMILES
CC(C)(C)OC(=O)N1CCN(c2cccc3cc[nH]c23)CC1- InChIKey
YTXGTLBHRQYTPM-UHFFFAOYSA-N- Molecular formula
- C17H23N3O2
- Average molar mass
- 301.4 g/mol
Names & identifiers
- Preferred name
- tert-butyl 4-(1H-indol-7-yl)piperazine-1-carboxylate
- IUPAC
- tert-butyl 4-(1H-indol-7-yl)piperazine-1-carboxylate
Names & synonyms
tert-butyl 4-(1H-indol-7-yl)piperazine-1-carboxylate444620-75-1SCHEMBL5205461SCHEMBL30885785YTXGTLBHRQYTPM-UHFFFAOYSA-NDA-424277-(4-t-Butyloxycarbonylpiperazin-1-yl)indole4-(1H-Indol-7-yl)-piperazine-1-carboxylic acid tert-butyl ester4-(1H-indol-7-yl)piperazine-1-carboxylic acid tert-butyl ester
Database identifiers
- PubChem CID
- 21070951
Properties
Computed structural properties
- XLogP
- 2.8
- Topological polar surface area
- 48.6 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 22
- Formal charge
- 0
- Complexity
- 399
Related reactions
3 records
Compound notes
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