1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one

C19H16FNO2 — CID 10193191

IUPAC1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one
SMILESO=c1cc(OCc2ccccc2)ccn1Cc1ccc(F)cc1
InChIInChI=1S/C19H16FNO2/c20-17-8-6-15(7-9-17)13-21-11-10-18(12-19(21)22)23-14-16-4-2-1-3-5-16/h1-12H,13-14H2
InChIKeyMGXOGUHVTDUHDM-UHFFFAOYSA-N
MW309.34 g/mol
LogP3.61
Rot. Bonds5

About 1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one

1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one (PubChem CID 10193191) has the molecular formula C19H16FNO2 and a molecular weight of 309.34 g/mol. Its IUPAC name is 1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one.

Molecular Properties

Compound Name1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one
PubChem CID10193191
Molecular FormulaC19H16FNO2
Molecular Weight309.34 g/mol
Exact Mass309.12
IUPAC Name1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one
SMILESO=c1cc(OCc2ccccc2)ccn1Cc1ccc(F)cc1
InChIInChI=1S/C19H16FNO2/c20-17-8-6-15(7-9-17)13-21-11-10-18(12-19(21)22)23-14-16-4-2-1-3-5-16/h1-12H,13-14H2
InChIKeyMGXOGUHVTDUHDM-UHFFFAOYSA-N
XLogP3.61
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.34
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-benzyl-4-(benzyloxy)-3-bromopyridin-2(1H)-one
CID 10126288
1-benzyl-3-(benzyloxy)-2-methyl-4(1H)-pyridinone
CID 660782
3-bromo-1-(3-fluorobenzyl)-4-(4-fluorobenzyloxy)pyridin-2(1H)-one
CID 10194381
3-bromo-4-(2,4-difluorobenzyloxy)-1-(3-fluorobenzyl)pyridin-2(1H)-one
CID 10216550
1-benzyl-4-(benzyloxy)-3-chloropyridin-2(1H)-one
CID 10236731
1-(3-(aminomethyl)benzyl)-3-bromo-4-(2,4-difluorobenzyloxy)-6-methylpyridin-2(1H)-one
CID 11155124
1-(4-(aminomethyl)benzyl)-3-bromo-4-(2,4-difluorobenzyloxy)-6-methylpyridin-2(1H)-one
CID 11178413
4-((3-bromo-4-(2,4-difluorobenzyloxy)-6-methyl-2-oxopyridin-1(2H)-yl)methyl)benzonitrile
CID 11270757
3-bromo-4-(2,4-difluorobenzyloxy)-1-(4-((dimethylamino)methyl)benzyl)-6-methylpyridin-2(1H)-one
CID 22050722
3-bromo-4-(2,4-difluorobenzyloxy)-1-(3-((dimethylamino)methyl)benzyl)-6-methylpyridin-2(1H)-one
CID 22050741
4-(4-fluorobenzyloxy)-1-(4-((propylamino)methyl)phenethyl)pyridin-2(1H)-one
CID 44469273
1-(4-((cyclopentyl(propyl)amino)methyl)phenethyl)-4-(4-fluorobenzyloxy)pyridin-2(1H)-one
CID 45487283

Frequently Asked Questions

What is the IUPAC name of 1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one?
The IUPAC name of 1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one (CID 10193191) is 1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one.
What is the SMILES notation for 1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one?
The canonical SMILES for 1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one is O=c1cc(OCc2ccccc2)ccn1Cc1ccc(F)cc1.
What is the InChIKey of 1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one?
The InChIKey is MGXOGUHVTDUHDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FNO2/c20-17-8-6-15(7-9-17)13-21-11-10-18(12-19(21)22)23-14-16-4-2-1-3-5-16/h1-12H,13-14H2.
What are the key properties of 1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one?
1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one has a molecular weight of 309.34 g/mol, XLogP of 3.61, 5 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(4-fluorophenyl)methyl]-4-phenylmethoxypyridin-2-one is sourced from PubChem (CID 10193191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).