Pyriclor

C5H2Cl3NO — CID 16076

About Pyriclor

Pyriclor (PubChem CID 16076) has the molecular formula C5H2Cl3NO and a molecular weight of 198.43 g/mol. Its IUPAC name is 2,3,5-trichloro-1H-pyridin-4-one.

Molecular Properties

Compound NamePyriclor
PubChem CID16076
Molecular FormulaC5H2Cl3NO
Molecular Weight198.43 g/mol
Exact Mass196.92
IUPAC Name2,3,5-trichloro-1H-pyridin-4-one
SMILESC1=C(C(=O)C(=C(N1)Cl)Cl)Cl
InChIKeyXTVIFVALDYTCLL-UHFFFAOYSA-N
XLogP2.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds0
Heavy Atoms10
Complexity243

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.43
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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