2-[(2-Chloro-5-ethyl pyridine-3-yl)(hydroxy)methyl]cyclopent-2-en-1-one

HCID 58880239
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Basic information

Standard SMILES
CCc1cnc(Cl)c(C(O)C2=CCCC2=O)c1
InChIKey
LAXOATSCWNMTGT-UHFFFAOYSA-N
Molecular formula
C13H14ClNO2
Average molar mass
251.71 g/mol

Names & identifiers

Preferred name
2-[(2-Chloro-5-ethyl pyridine-3-yl)(hydroxy)methyl]cyclopent-2-en-1-one
IUPAC
2-[(2-chloro-5-ethyl-3-pyridinyl)-hydroxymethyl]cyclopent-2-en-1-one

Names & synonyms

SCHEMBL2853090LAXOATSCWNMTGT-UHFFFAOYSA-N2-[(2-Chloro-5-ethyl pyridine-3-yl)(hydroxy)methyl]cyclopent-2-en-1-one

Database identifiers

PubChem CID
58880239

Properties

Computed structural properties

XLogP
2.6
Topological polar surface area
50.2 Ų
Hydrogen bond donors
1
Hydrogen bond acceptors
3
Rotatable bonds
3
Heavy atoms
17

Related reactions

2 records
New reaction record

Compound notes

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