1-benzyl-5-(4-fluorophenyl)pyridin-2-one

C18H14FNO — CID 4108650

IUPAC1-benzyl-5-(4-fluorophenyl)pyridin-2-one
SMILESO=c1ccc(-c2ccc(F)cc2)cn1Cc1ccccc1
InChIInChI=1S/C18H14FNO/c19-17-9-6-15(7-10-17)16-8-11-18(21)20(13-16)12-14-4-2-1-3-5-14/h1-11,13H,12H2
InChIKeyWRWBEVURJJWAIO-UHFFFAOYSA-N
MW279.31 g/mol
LogP3.70
Rot. Bonds3

About 1-benzyl-5-(4-fluorophenyl)pyridin-2-one

1-benzyl-5-(4-fluorophenyl)pyridin-2-one (PubChem CID 4108650) has the molecular formula C18H14FNO and a molecular weight of 279.31 g/mol. Its IUPAC name is 1-benzyl-5-(4-fluorophenyl)pyridin-2-one.

Molecular Properties

Compound Name1-benzyl-5-(4-fluorophenyl)pyridin-2-one
PubChem CID4108650
Molecular FormulaC18H14FNO
Molecular Weight279.31 g/mol
Exact Mass279.11
IUPAC Name1-benzyl-5-(4-fluorophenyl)pyridin-2-one
SMILESO=c1ccc(-c2ccc(F)cc2)cn1Cc1ccccc1
InChIInChI=1S/C18H14FNO/c19-17-9-6-15(7-10-17)16-8-11-18(21)20(13-16)12-14-4-2-1-3-5-14/h1-11,13H,12H2
InChIKeyWRWBEVURJJWAIO-UHFFFAOYSA-N
XLogP3.70
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.31
LogP ≤ 53.70
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-benzyl-5-(4-fluorophenyl)pyridin-2-one?
The IUPAC name of 1-benzyl-5-(4-fluorophenyl)pyridin-2-one (CID 4108650) is 1-benzyl-5-(4-fluorophenyl)pyridin-2-one.
What is the SMILES notation for 1-benzyl-5-(4-fluorophenyl)pyridin-2-one?
The canonical SMILES for 1-benzyl-5-(4-fluorophenyl)pyridin-2-one is O=c1ccc(-c2ccc(F)cc2)cn1Cc1ccccc1.
What is the InChIKey of 1-benzyl-5-(4-fluorophenyl)pyridin-2-one?
The InChIKey is WRWBEVURJJWAIO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14FNO/c19-17-9-6-15(7-10-17)16-8-11-18(21)20(13-16)12-14-4-2-1-3-5-14/h1-11,13H,12H2.
What are the key properties of 1-benzyl-5-(4-fluorophenyl)pyridin-2-one?
1-benzyl-5-(4-fluorophenyl)pyridin-2-one has a molecular weight of 279.31 g/mol, XLogP of 3.70, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-5-(4-fluorophenyl)pyridin-2-one is sourced from PubChem (CID 4108650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).