1-[2-(Chroman-3-yl)ethyl]-1,2,5,6-tetrahydropyridine-3-carboxylic acid ethyl ester

HCID 14838433
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Basic information

Standard SMILES
CCOC(=O)C1=CCCN(CCC2COc3ccccc3C2)C1
InChIKey
SBUFYHBOJJKYFW-UHFFFAOYSA-N
Molecular formula
C19H25NO3
Average molar mass
315.4 g/mol
Monoisotopic mass
315.18344366

Names & identifiers

Preferred name
1-[2-(Chroman-3-yl)ethyl]-1,2,5,6-tetrahydropyridine-3-carboxylic acid ethyl ester
IUPAC
ethyl 1-[2-(3,4-dihydro-2H-chromen-3-yl)ethyl]-3,6-dihydro-2H-pyridine-5-carboxylate

Names & synonyms

SCHEMBL9690323SBUFYHBOJJKYFW-UHFFFAOYSA-N1-[2-(chroman-3-yl)ethyl]-1,2,5,6-tetrahydropyridine-3-carboxylic acid ethyl ester

Database identifiers

PubChem CID
14838433

Properties

Computed structural properties

XLogP
3.2
Topological polar surface area
38.8 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
4
Rotatable bonds
6
Heavy atoms
23

Related reactions

6 records
New reaction record

Compound notes

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