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N,N-dimethyl-1-(phenylmethyl)-3-pyrrolidinemethanamine

HCID 14280892
NotesReactions

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Basic informationNames & identifiersPropertiesRelated reactionsCompound notes
Substructure searchFind similar structures

Basic information

Standard SMILES
CN(C)CC1CCN(Cc2ccccc2)C1
InChIKey
FOSNQWWFKGJNOZ-UHFFFAOYSA-N
Molecular formula
C14H22N2
Average molar mass
218.34 g/mol
Monoisotopic mass
218.17829871

Names & identifiers

Preferred name
N,N-dimethyl-1-(phenylmethyl)-3-pyrrolidinemethanamine
IUPAC
1-(1-benzylpyrrolidin-3-yl)-N,N-dimethylmethanamine

Names & synonyms

SCHEMBL9437294FOSNQWWFKGJNOZ-UHFFFAOYSA-NN,N-dimethyl-1-(phenylmethyl)-3-pyrrolidinemethanamine

Database identifiers

PubChem CID
14280892

Properties

Computed structural propertiesFilling in

XLogP
2.2
Topological polar surface area
6.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
197

Related reactions

11 records
New reaction record
HRID 144196 reaction equation
HRID 144196As reactantTraining data from https://doi.org/10.1039/C8SC04228D (9/10)
HRID 622574 reaction equation
HRID 622574As productuspto-grants-1988_09
HRID 622575 reaction equation
HRID 622575As reactantuspto-grants-1988_09
HRID 868138 reaction equation
HRID 868138As productuspto-grants-1988_10
HRID 868139 reaction equation
HRID 868139As reactantuspto-grants-1988_10
HRID 978592 reaction equation
HRID 978592As productuspto-grants-1987_05
HRID 978593 reaction equation
HRID 978593As reactantuspto-grants-1987_05
HRID 980743 reaction equation
HRID 980743As productuspto-grants-1987_01
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Compound notes

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