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

C11H7ClFNO — CID 106520964

IUPAC2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one
SMILESO=c1cc[nH]c(-c2ccc(F)cc2Cl)c1
InChIInChI=1S/C11H7ClFNO/c12-10-5-7(13)1-2-9(10)11-6-8(15)3-4-14-11/h1-6H,(H,14,15)
InChIKeyPSZYLQXFLYVEEE-UHFFFAOYSA-N
MW223.63 g/mol
LogP2.83
Rot. Bonds1

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

2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one (PubChem CID 106520964) has the molecular formula C11H7ClFNO and a molecular weight of 223.63 g/mol. Its IUPAC name is 2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one.

Molecular Properties

Compound Name2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one
PubChem CID106520964
Molecular FormulaC11H7ClFNO
Molecular Weight223.63 g/mol
Exact Mass223.02
IUPAC Name2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one
SMILESO=c1cc[nH]c(-c2ccc(F)cc2Cl)c1
InChIInChI=1S/C11H7ClFNO/c12-10-5-7(13)1-2-9(10)11-6-8(15)3-4-14-11/h1-6H,(H,14,15)
InChIKeyPSZYLQXFLYVEEE-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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Related Compounds

1-(2-chloro-6-fluorobenzyl)pyridin-2(1H)-one
CID 943457
3-{[(4-Chlorophenyl)methyl]amino}cyclohex-2-en-1-one
CID 975254
1-(2-chlorobenzyl)-4(1H)-pyridinone
CID 1253322
3-(Tert-butylamino)-4-[(2-chloro-4-fluorophenyl)methylamino]cyclobut-3-ene-1,2-dione
CID 10614931
4-Hydroxy-2-phenylpyridine
CID 598779
2-(3-Fluorophenyl)pyridin-4-ol
CID 53229143
2-(4-Fluorophenyl)pyridin-4(1H)-one
CID 53229144
2-(4-chloro-3-fluorophenyl)-1H-pyridin-4-one
CID 58134347
3-Amino-1-[(2-chloro-6-fluorophenyl)methyl]pyridin-2-one
CID 62100804
2-(2,3-difluorophenyl)-5-methyl-1H-pyridin-4-one
CID 68925611
2-(2-Chloro-3-methylphenyl)-1-[(2-fluorophenyl)methyl]pyridin-4-one
CID 134565207
2-[2-chloro-3-(trifluoromethyl)phenyl]-1H-pyridin-4-one
CID 134565966

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one?
The IUPAC name of 2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one (CID 106520964) is 2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one.
What is the SMILES notation for 2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one?
The canonical SMILES for 2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one is O=c1cc[nH]c(-c2ccc(F)cc2Cl)c1.
What is the InChIKey of 2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one?
The InChIKey is PSZYLQXFLYVEEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H7ClFNO/c12-10-5-7(13)1-2-9(10)11-6-8(15)3-4-14-11/h1-6H,(H,14,15).
What are the key properties of 2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one?
2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-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 2-(2-chloro-4-fluorophenyl)-1H-pyridin-4-one is sourced from PubChem (CID 106520964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).