6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one

C17H12ClNO — CID 18987356

IUPAC6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one
SMILESO=c1cc(-c2ccccc2)cc(-c2ccc(Cl)cc2)[nH]1
InChIInChI=1S/C17H12ClNO/c18-15-8-6-13(7-9-15)16-10-14(11-17(20)19-16)12-4-2-1-3-5-12/h1-11H,(H,19,20)
InChIKeyKJJSWYYDDXXHIM-UHFFFAOYSA-N
MW281.74 g/mol
LogP4.36
Rot. Bonds2

About 6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one

6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one (PubChem CID 18987356) has the molecular formula C17H12ClNO and a molecular weight of 281.74 g/mol. Its IUPAC name is 6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one.

Molecular Properties

Compound Name6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one
PubChem CID18987356
Molecular FormulaC17H12ClNO
Molecular Weight281.74 g/mol
Exact Mass281.06
IUPAC Name6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one
SMILESO=c1cc(-c2ccccc2)cc(-c2ccc(Cl)cc2)[nH]1
InChIInChI=1S/C17H12ClNO/c18-15-8-6-13(7-9-15)16-10-14(11-17(20)19-16)12-4-2-1-3-5-12/h1-11H,(H,19,20)
InChIKeyKJJSWYYDDXXHIM-UHFFFAOYSA-N
XLogP4.36
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.74
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one?
The IUPAC name of 6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one (CID 18987356) is 6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one.
What is the SMILES notation for 6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one?
The canonical SMILES for 6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one is O=c1cc(-c2ccccc2)cc(-c2ccc(Cl)cc2)[nH]1.
What is the InChIKey of 6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one?
The InChIKey is KJJSWYYDDXXHIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H12ClNO/c18-15-8-6-13(7-9-15)16-10-14(11-17(20)19-16)12-4-2-1-3-5-12/h1-11H,(H,19,20).
What are the key properties of 6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one?
6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one has a molecular weight of 281.74 g/mol, XLogP of 4.36, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-chlorophenyl)-4-phenyl-1H-pyridin-2-one is sourced from PubChem (CID 18987356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).