Basic information
- Standard SMILES
CCCCCCc1nc2cc3c(cc2[nH]1)NC(=O)C3(C)C- InChIKey
IQQIIPCAOOITCP-UHFFFAOYSA-N- Molecular formula
- C17H23N3O
- Average molar mass
- 285.4 g/mol
- Monoisotopic mass
- 285.18411237
Names & identifiers
- Preferred name
- 2-n-Hexyl-7,7-dimethyl-6,7-dihydro-3H,5H-pyrrolo[2,3-f]benzimidazol-6-one
- IUPAC
- 2-hexyl-7,7-dimethyl-1,5-dihydropyrrolo[2,3-f]benzimidazol-6-one
Names & synonyms
SCHEMBL9835224IQQIIPCAOOITCP-UHFFFAOYSA-N2-n-Hexyl-7,7-dimethyl-6,7-dihydro-3H,5H-pyrrolo[2,3-f]benzimidazol-6-one
Database identifiers
- PubChem CID
- 14458609
Properties
Computed structural properties
- XLogP
- 4.1
- Topological polar surface area
- 57.8 Ų
- Hydrogen bond donors
- 2
- Hydrogen bond acceptors
- 2
- Rotatable bonds
- 5
- Heavy atoms
- 21
- Formal charge
- 0
- Complexity
- 395
Related reactions
1 records
Compound notes
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