3-(Benzylamino-methyl)-benzoic acid methyl ester

HCID 59190859
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Basic information

Standard SMILES
COC(=O)c1cccc(CNCc2ccccc2)c1
InChIKey
HBPUVIARTMVZHB-UHFFFAOYSA-N
Molecular formula
C16H17NO2
Average molar mass
255.31 g/mol

Names & identifiers

Preferred name
3-(Benzylamino-methyl)-benzoic acid methyl ester
IUPAC
methyl 3-[(benzylamino)methyl]benzoate

Names & synonyms

SCHEMBL308038HBPUVIARTMVZHB-UHFFFAOYSA-N3-(benzylamino-methyl)-benzoic acid methyl ester

Database identifiers

PubChem CID
59190859

Properties

Computed structural properties

XLogP
3.3
Topological polar surface area
38.3 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
6
Heavy atoms
19

Related reactions

4 records
New reaction record

Linked notes

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