Basic information
- Standard SMILES
CC(C)(C)c1cc2cc(Cl)ncc2[nH]1- InChIKey
ZRHIWXLAIHOAQI-UHFFFAOYSA-N- Molecular formula
- C11H13ClN2
- Average molar mass
- 208.69 g/mol
Names & identifiers
- Preferred name
- 2-tert-butyl-5-chloro-1H-pyrrolo[2,3-c]pyridine
- IUPAC
- 2-tert-butyl-5-chloro-1H-pyrrolo[2,3-c]pyridine
Names & synonyms
2-tert-butyl-5-chloro-1H-pyrrolo[2,3-c]pyridine1072085-74-5SCHEMBL4253736ZRHIWXLAIHOAQI-UHFFFAOYSA-NDB-3143522-(tert-butyl)-5-chloro-1H-pyrrolo[2,3-c]pyridine
Database identifiers
- PubChem CID
- 57908151
Properties
Computed structural properties
- XLogP
- 3.6
- Topological polar surface area
- 28.7 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 1
- Rotatable bonds
- 1
- Heavy atoms
- 14
- Formal charge
- 0
- Complexity
- 212
Related reactions
5 records
Compound notes
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