Basic information
- Standard SMILES
N#Cc1cnc(Nc2cc(NCC3CCCNC3)c(N3CCCC3)cn2)cn1- InChIKey
SOEZBNINDNIVAE-UHFFFAOYSA-N- Molecular formula
- C20H26N8
- Average molar mass
- 378.5 g/mol
Names & identifiers
- Preferred name
- 5-(4-(Piperidin-3-ylmethylamino)-5-(pyrrolidin-1-yl)pyridin-2-ylamino)pyrazine-2-carbonitrile
- IUPAC
- 5-[[4-(piperidin-3-ylmethylamino)-5-pyrrolidin-1-yl-2-pyridinyl]amino]pyrazine-2-carbonitrile
Names & synonyms
SCHEMBL618177SOEZBNINDNIVAE-UHFFFAOYSA-N5-(4-(piperidin-3-ylmethylamino)-5-(pyrrolidin-1-yl)pyridin-2-ylamino)pyrazine-2-carbonitrile
Database identifiers
- PubChem CID
- 59613506
Properties
Computed structural properties
- XLogP
- 1.9
- Topological polar surface area
- 102 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 8
- Rotatable bonds
- 6
- Heavy atoms
- 28
- Formal charge
- 0
- Complexity
- 528
Related reactions
2 records
Compound notes
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