1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one

C14H10FN3O2 — CID 47045849

IUPAC1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
SMILESO=c1ccc(-c2nnco2)cn1Cc1ccccc1F
InChIInChI=1S/C14H10FN3O2/c15-12-4-2-1-3-10(12)7-18-8-11(5-6-13(18)19)14-17-16-9-20-14/h1-6,8-9H,7H2
InChIKeyOJPUVYIRYMOEDU-UHFFFAOYSA-N
MW271.25 g/mol
LogP2.09
Rot. Bonds3

About 1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one

1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one (PubChem CID 47045849) has the molecular formula C14H10FN3O2 and a molecular weight of 271.25 g/mol. Its IUPAC name is 1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one.

Molecular Properties

Compound Name1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
PubChem CID47045849
Molecular FormulaC14H10FN3O2
Molecular Weight271.25 g/mol
Exact Mass271.08
IUPAC Name1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
SMILESO=c1ccc(-c2nnco2)cn1Cc1ccccc1F
InChIInChI=1S/C14H10FN3O2/c15-12-4-2-1-3-10(12)7-18-8-11(5-6-13(18)19)14-17-16-9-20-14/h1-6,8-9H,7H2
InChIKeyOJPUVYIRYMOEDU-UHFFFAOYSA-N
XLogP2.09
TPSA60.92 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.25
LogP ≤ 52.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(2-fluorophenoxy)ethyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
CID 47045848
5-(1,3,4-oxadiazol-2-yl)-1-[(1-phenylpyrazol-4-yl)methyl]pyridin-2-one
CID 167838278
1-[[1-(difluoromethyl)benzimidazol-2-yl]methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
CID 47058481
1-[(3-benzyl-1,2,4-oxadiazol-5-yl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
CID 47045867
1-[(5-chloro-2,3-dihydro-1,4-benzodioxin-7-yl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one
CID 53498269
1-[(2-fluorophenyl)methyl]pyridin-2-one
CID 664770
N-[(2-fluorophenyl)methyl]-2-[3-(1,3,4-oxadiazol-2-yl)indol-1-yl]acetamide
CID 53027936
2-[2-(2-fluorophenyl)ethyl]-1,3,4-oxadiazole
CID 171373656
2-[2-[(2-fluorophenyl)methyl]-5-pyridin-2-yl-1,2,4-triazol-3-yl]-1,3,4-oxadiazole
CID 69281051
5-(1-benzofuran-2-yl)-1-[(2,4-difluorophenyl)methyl]pyridin-2-one
CID 4253035
6-(4-fluorophenyl)-2-[(2-fluorophenyl)methyl]pyridazin-3-one
CID 7664368
5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-(pyridin-3-ylmethyl)pyridin-2-one
CID 166850879

Frequently Asked Questions

What is the IUPAC name of 1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one?
The IUPAC name of 1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one (CID 47045849) is 1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one.
What is the SMILES notation for 1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one?
The canonical SMILES for 1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one is O=c1ccc(-c2nnco2)cn1Cc1ccccc1F.
What is the InChIKey of 1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one?
The InChIKey is OJPUVYIRYMOEDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H10FN3O2/c15-12-4-2-1-3-10(12)7-18-8-11(5-6-13(18)19)14-17-16-9-20-14/h1-6,8-9H,7H2.
What are the key properties of 1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one?
1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one has a molecular weight of 271.25 g/mol, XLogP of 2.09, 3 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-fluorophenyl)methyl]-5-(1,3,4-oxadiazol-2-yl)pyridin-2-one is sourced from PubChem (CID 47045849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).