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1-(3-Chloropropyl)-4-phenylpiperidine

HCID 203689
NotesReactions
Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
ClCCCN1CCC(c2ccccc2)CC1
InChIKey
PEXVQAFFEHJDBW-UHFFFAOYSA-N
Molecular formula
C14H20ClN
Average molar mass
237.77 g/mol

Names & identifiers

Preferred name
1-(3-Chloropropyl)-4-phenylpiperidine
IUPAC
1-(3-chloropropyl)-4-phenylpiperidine

Names & synonyms

1-(3-chloropropyl)-4-phenylpiperidine15037-34-01-(3-chloropropyl)-4-phenyl-piperidineSCHEMBL2554214PEXVQAFFEHJDBW-UHFFFAOYSA-N1-chloro-3-(4-phenylpiperidinyl)propane1-(3-Chloropropyl)-4-phenyl-1,2,4,6-tetrahydropyridine

Database identifiers

PubChem CID
203689

Properties

Computed structural properties

XLogP
3.4
Topological polar surface area
3.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
181

Related reactions

19 records
New reaction record
HRID 22329 reaction equation
HRID 22329As reactantuspto-grants-1995_06
HRID 22332 reaction equation
HRID 22332As reactantuspto-grants-1995_06
HRID 122964 reaction equation
HRID 122964As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 184100 reaction equation
HRID 184100As reactantTraining data from https://doi.org/10.1039/C8SC04228D (6/10)
HRID 315770 reaction equation
HRID 315770As reactantTraining data from https://doi.org/10.1039/C8SC04228D (8/10)
HRID 461015 reaction equation
HRID 461015As reactantuspto-grants-1977_12
HRID 478201 reaction equation
HRID 478201As reactantuspto-grants-2003_11
HRID 654095 reaction equation
HRID 654095As reactantuspto-grants-1992_07
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Compound notes

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