4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one

C11H7ClFNO — CID 90095686

IUPAC4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one
SMILESO=c1cc(Cl)c(-c2ccc(F)cc2)c[nH]1
InChIInChI=1S/C11H7ClFNO/c12-10-5-11(15)14-6-9(10)7-1-3-8(13)4-2-7/h1-6H,(H,14,15)
InChIKeyCWHODLHNZDSMHO-UHFFFAOYSA-N
MW223.63 g/mol
LogP2.83
Rot. Bonds1

About 4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one

4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one (PubChem CID 90095686) has the molecular formula C11H7ClFNO and a molecular weight of 223.63 g/mol. Its IUPAC name is 4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one.

Molecular Properties

Compound Name4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one
PubChem CID90095686
Molecular FormulaC11H7ClFNO
Molecular Weight223.63 g/mol
Exact Mass223.02
IUPAC Name4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one
SMILESO=c1cc(Cl)c(-c2ccc(F)cc2)c[nH]1
InChIInChI=1S/C11H7ClFNO/c12-10-5-11(15)14-6-9(10)7-1-3-8(13)4-2-7/h1-6H,(H,14,15)
InChIKeyCWHODLHNZDSMHO-UHFFFAOYSA-N
XLogP2.83
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.63
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one?
The IUPAC name of 4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one (CID 90095686) is 4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one.
What is the SMILES notation for 4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one?
The canonical SMILES for 4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one is O=c1cc(Cl)c(-c2ccc(F)cc2)c[nH]1.
What is the InChIKey of 4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one?
The InChIKey is CWHODLHNZDSMHO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClFNO/c12-10-5-11(15)14-6-9(10)7-1-3-8(13)4-2-7/h1-6H,(H,14,15).
What are the key properties of 4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one?
4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one has a molecular weight of 223.63 g/mol, XLogP of 2.83, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-5-(4-fluorophenyl)-1H-pyridin-2-one is sourced from PubChem (CID 90095686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).