Basic information
- Standard SMILES
CCCCc1nnc2c(NC3CCCC3)nc3ccccc3n12- InChIKey
NAWMTTGVHZYAFV-UHFFFAOYSA-N- Molecular formula
- C18H23N5
- Average molar mass
- 309.4 g/mol
Names & identifiers
- Preferred name
- 1-Butyl-N-cyclopentyl[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
- IUPAC
- 1-butyl-N-cyclopentyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-amine
Names & synonyms
CHEMBL7454SCHEMBL7347595NAWMTTGVHZYAFV-UHFFFAOYSA-NBDBM500234831-Butyl-N-cyclopentyl[1,2,4]triazolo[4,3-a]quinoxalin-4-amine(1-Butyl-[1,2,4]triazolo[4,3-a]quinoxalin-4-yl)-cyclopentyl-amine
Database identifiers
- PubChem CID
- 14280612
- ChEMBL
CHEMBL7454- Nikkaji
- J852.296K
Properties
Computed structural properties
- XLogP
- 4.8
- Topological polar surface area
- 55.1 Ų
- Hydrogen bond donors
- 1
- Hydrogen bond acceptors
- 4
- Rotatable bonds
- 5
- Heavy atoms
- 23
- Formal charge
- 0
- Complexity
- 384
Related reactions
1 records
Compound notes
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