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5-[2-(3-Fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine

HCID 67329536
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
Nc1cnn2ccc(N3CCCC3c3cccc(F)c3)nc12
InChIKey
GBWVWAPFLHOIKT-UHFFFAOYSA-N
Molecular formula
C16H16FN5
Average molar mass
297.33 g/mol
Monoisotopic mass
297.13897369

Names & identifiers

Preferred name
5-[2-(3-Fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine
IUPAC
5-[2-(3-fluorophenyl)pyrrolidin-1-yl]pyrazolo[1,5-a]pyrimidin-3-amine

Names & synonyms

SCHEMBL2238190SCHEMBL29429635

Database identifiers

PubChem CID
67329536

Properties

Computed structural properties

XLogP
2.2
Topological polar surface area
59.5 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
5
Rotatable bonds
2
Heavy atoms
22
Formal charge
0
Complexity
395

Related reactions

5 records
New reaction record
HRID 95505 reaction equation
HRID 95505As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 119663 reaction equation
HRID 119663As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 697723 reaction equation
HRID 697723As reactantTraining data from https://doi.org/10.1039/C8SC04228D (3/10)
HRID 1126070 reaction equation
HRID 1126070As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)
HRID 1137755 reaction equation
HRID 1137755As reactantTraining data from https://doi.org/10.1039/C8SC04228D (7/10)

Compound notes

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