3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one

C22H15ClN2O — CID 10269791

IUPAC3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one
SMILESO=c1c(-c2ccccc2Cl)cc(-c2ccccn2)cn1-c1ccccc1
InChIInChI=1S/C22H15ClN2O/c23-20-11-5-4-10-18(20)19-14-16(21-12-6-7-13-24-21)15-25(22(19)26)17-8-2-1-3-9-17/h1-15H
InChIKeyQLYBJSAIVVWOPP-UHFFFAOYSA-N
MW358.83 g/mol
LogP5.22
Rot. Bonds3

About 3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one

3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one (PubChem CID 10269791) has the molecular formula C22H15ClN2O and a molecular weight of 358.83 g/mol. Its IUPAC name is 3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one.

Molecular Properties

Compound Name3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one
PubChem CID10269791
Molecular FormulaC22H15ClN2O
Molecular Weight358.83 g/mol
Exact Mass358.09
IUPAC Name3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one
SMILESO=c1c(-c2ccccc2Cl)cc(-c2ccccn2)cn1-c1ccccc1
InChIInChI=1S/C22H15ClN2O/c23-20-11-5-4-10-18(20)19-14-16(21-12-6-7-13-24-21)15-25(22(19)26)17-8-2-1-3-9-17/h1-15H
InChIKeyQLYBJSAIVVWOPP-UHFFFAOYSA-N
XLogP5.22
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500358.83
LogP ≤ 55.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one?
The IUPAC name of 3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one (CID 10269791) is 3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one.
What is the SMILES notation for 3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one?
The canonical SMILES for 3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one is O=c1c(-c2ccccc2Cl)cc(-c2ccccn2)cn1-c1ccccc1.
What is the InChIKey of 3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one?
The InChIKey is QLYBJSAIVVWOPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H15ClN2O/c23-20-11-5-4-10-18(20)19-14-16(21-12-6-7-13-24-21)15-25(22(19)26)17-8-2-1-3-9-17/h1-15H.
What are the key properties of 3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one?
3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one has a molecular weight of 358.83 g/mol, XLogP of 5.22, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-chlorophenyl)-1-phenyl-5-pyridin-2-ylpyridin-2-one is sourced from PubChem (CID 10269791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).