Methyl 3-methyl-5-{[methyl(pentyl)amino]methyl}benzoate

HCID 21086189
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Basic information

Standard SMILES
CCCCCN(C)Cc1cc(C)cc(C(=O)OC)c1
InChIKey
TUDVXMOZEXWJJP-UHFFFAOYSA-N
Molecular formula
C16H25NO2
Average molar mass
263.37 g/mol
Monoisotopic mass
263.18852904

Names & identifiers

Preferred name
Methyl 3-methyl-5-{[methyl(pentyl)amino]methyl}benzoate
IUPAC
methyl 3-methyl-5-[[methyl(pentyl)amino]methyl]benzoate

Names & synonyms

SCHEMBL3348831TUDVXMOZEXWJJP-UHFFFAOYSA-NMethyl 3-methyl-5-{[methyl(pentyl)amino]methyl}benzoate

Database identifiers

PubChem CID
21086189

Properties

Computed structural properties

XLogP
3.8
Topological polar surface area
29.5 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
3
Rotatable bonds
8
Heavy atoms
19

Related reactions

6 records
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Compound notes

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