N-[[1-(3-aminopropyl)-5-oxopyrrolidin-2-yl]methyl]-6-(2-cyanophenyl)-2-[2-(3-fluorophenyl)ethylamino]pyridine-3-carboxamide
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Basic information
- Standard SMILES
N#Cc1ccccc1-c1ccc(C(=O)NCC2CCC(=O)N2CCCN)c(NCCc2cccc(F)c2)n1- InChIKey
FOVJDWVVQWCOQL-UHFFFAOYSA-N- Molecular formula
- C29H31FN6O2
- Average molar mass
- 514.6 g/mol
Names & identifiers
- Preferred name
- N-[[1-(3-aminopropyl)-5-oxopyrrolidin-2-yl]methyl]-6-(2-cyanophenyl)-2-[2-(3-fluorophenyl)ethylamino]pyridine-3-carboxamide
- IUPAC
- N-[[1-(3-aminopropyl)-5-oxopyrrolidin-2-yl]methyl]-6-(2-cyanophenyl)-2-[2-(3-fluorophenyl)ethylamino]pyridine-3-carboxamide
Names & synonyms
SCHEMBL1631435
Database identifiers
- PubChem CID
- 67101367
Properties
Computed structural propertiesFilling in
- XLogP
- 3.5
- Topological polar surface area
- 124 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 7
- Rotatable bonds
- 11
- Heavy atoms
- 38
- Formal charge
- 0
- Complexity
- 833
Related reactions
1 records
Compound notes
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