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2-(Methylamino)-1-[4-(pyrrolidin-1-yl)phenyl]ethan-1-ol

HCID 21098586
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Basic information

Standard SMILES
CNCC(O)c1ccc(N2CCCC2)cc1
InChIKey
HRBHSVAVZJRDJZ-UHFFFAOYSA-N
Molecular formula
C13H20N2O
Average molar mass
220.31 g/mol
Monoisotopic mass
220.15756327

Names & identifiers

Preferred name
2-(Methylamino)-1-[4-(pyrrolidin-1-yl)phenyl]ethan-1-ol
IUPAC
2-(methylamino)-1-(4-pyrrolidin-1-ylphenyl)ethanol

Names & synonyms

2-(methylamino)-1-[4-(pyrrolidin-1-yl)phenyl]ethan-1-ol864960-88-3SCHEMBL5358917HRBHSVAVZJRDJZ-UHFFFAOYSA-NEN300-17870702-methylamino-1-(4-pyrrolidine-1-yl-phenyl)-ethanol

Database identifiers

PubChem CID
21098586

Properties

Computed structural properties

XLogP
0.3
Topological polar surface area
35.5 Ų
Hydrogen bond donors
2
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
16
Formal charge
0
Complexity
196

Related reactions

2 records
New reaction record
HRID 119490 reaction equation
HRID 119490As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)
HRID 1351280 reaction equation
HRID 1351280As reactantuspto-grants-2007_05

Compound notes

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