Basic information
- Standard SMILES
CCn1cc(-c2ccnc3[nH]ccc23)c(-c2ccc(N)cc2)n1- InChIKey
DTLLEIBHAHQUDG-UHFFFAOYSA-N- Molecular formula
- C18H17N5
- Average molar mass
- 303.4 g/mol
Names & identifiers
- Preferred name
- 4-[1-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1H-pyrazol-3-yl]aniline
- IUPAC
- 4-[1-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)pyrazol-3-yl]aniline
Names & synonyms
SCHEMBL4315153DTLLEIBHAHQUDG-UHFFFAOYSA-NDB-1668224-[1-ethyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1H-pyrazol-3-yl]aniline4-[1-Ethyl-4-(1H-pyrrolo[2,3-b]pyridin-4-yl)-1H-pyrazol-3-yl]benzenamine942919-13-3
Database identifiers
- PubChem CID
- 68999813
Properties
Computed structural properties
- XLogP
- 2.5
- Topological polar surface area
- 72.5 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 3
- Rotatable bonds
- 3
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 395
Related reactions
87 records
Linked notes
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