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HuagongsheHuagongshe Chemistry Print Report · For research reference only
HCID 86594171Generated: October 23, 2026

2,3,4,5-tetrahydro-1H-3-benzazepine-7-carboxylic acid prop-2-ynyl amide

https://huagongshe.com/en/chemical/86594171

2,3,4,5-tetrahydro-1H-3-benzazepine-7-carboxylic acid prop-2-ynyl amide molecular structure

Identifiers & Physical Properties

Molecular formulaC14H16N2O
Average molar mass228.29 g/mol
SMILESC#CCNC(=O)c1ccc2c(c1)CCNCC2
InChIKeyIQWWVHFYVBHAJE-UHFFFAOYSA-N
PubChem CID86594171

Chemical & Physical Properties

XLogP1.2
Topological polar surface area41.1
Hydrogen bond donors2
Hydrogen bond acceptors2
Rotatable bonds2
Heavy atoms17
Formal charge0
Complexity317