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N-([alpha-phenyl]-n-pentyl)-4-pyridinamine (HCID 23458002)|Huagongshe
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Compound
N-([alpha-phenyl]-n-pentyl)-4-pyridinamine
HCID
23458002
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Reactions
Basic information
Names & identifiers
Properties
Related reactions
Compound notes
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Basic information
Standard SMILES
CCCCC(Nc1ccncc1)c1ccccc1
InChIKey
QJJGPJWSIIQQGI-UHFFFAOYSA-N
Molecular formula
C16H20N2
Average molar mass
240.34 g/mol
Names & identifiers
Preferred name
N-([alpha-phenyl]-n-pentyl)-4-pyridinamine
IUPAC
N-(1-phenylpentyl)pyridin-4-amine
Names & synonyms
SCHEMBL11400305
QJJGPJWSIIQQGI-UHFFFAOYSA-N
N-([alpha-phenyl]-n-pentyl)-4-pyridinamine
Database identifiers
PubChem CID
23458002
Properties
Computed structural properties
XLogP
4.2
Topological polar surface area
24.9 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
2
Rotatable bonds
6
Heavy atoms
18
Formal charge
0
Complexity
205
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Related reactions
3 records
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As reactant
As product
As reagent
As catalyst
As solvent
HRID
193077
As product
Training data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID
1448605
As product
uspto-grants-1979_12
HRID
1680309
As product
uspto-grants-1981_06
Compound notes
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