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1-(4-(trans-4-Propylcyclohexyl)-cyclohexen-1-yl)-pyrrolidine

HCID 22384121
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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
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Basic information

Standard SMILES
CCCC1CCC(C2CC=C(N3CCCC3)CC2)CC1
InChIKey
YEFCIIKFUCQTRH-UHFFFAOYSA-N
Molecular formula
C19H33N
Average molar mass
275.5 g/mol

Names & identifiers

Preferred name
1-(4-(trans-4-Propylcyclohexyl)-cyclohexen-1-yl)-pyrrolidine
IUPAC
1-[4-(4-propylcyclohexyl)cyclohexen-1-yl]pyrrolidine

Names & synonyms

SCHEMBL6451857SCHEMBL6451862YEFCIIKFUCQTRH-JHJOSGQCSA-N1-(4-(trans-4-propylcyclohexyl)-cyclohexen-1-yl)-pyrrolidine

Database identifiers

PubChem CID
22384121

Properties

Computed structural properties

XLogP
6.4
Topological polar surface area
3.2 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
1
Rotatable bonds
4
Heavy atoms
20
Formal charge
0
Complexity
319

Related reactions

1 records
New reaction record
HRID 694680 reaction equation
HRID 694680As productTraining data from https://doi.org/10.1039/C8SC04228D (3/10)

Compound notes

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