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3-Pyridin-3-yl-5,6,7,8-tetrahydroindolizine-1-carbonyl chloride

HCID 20190403
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Basic information

Standard SMILES
O=C(Cl)c1cc(-c2cccnc2)n2c1CCCC2
InChIKey
GPLVWRLVJWHLPP-UHFFFAOYSA-N
Molecular formula
C14H13ClN2O
Average molar mass
260.72 g/mol

Names & identifiers

Preferred name
3-Pyridin-3-yl-5,6,7,8-tetrahydroindolizine-1-carbonyl chloride
IUPAC
3-pyridin-3-yl-5,6,7,8-tetrahydroindolizine-1-carbonyl chloride

Database identifiers

PubChem CID
20190403

Properties

Computed structural properties

XLogP
2.5
Topological polar surface area
34.9 Ų
Hydrogen bond donors
0
Hydrogen bond acceptors
2
Rotatable bonds
2
Heavy atoms
18
Formal charge
0
Complexity
323

Related reactions

1 records
New reaction record
HRID 86196 reaction equation
HRID 86196As reactantTraining data from https://doi.org/10.1039/C8SC04228D (2/10)

Compound notes

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