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

C19H12ClFN4O2 — CID 166850657

IUPAC5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one
SMILESO=c1ccc(-c2nc(-c3cccc(Cl)c3)no2)cn1Cc1cncc(F)c1
InChIInChI=1S/C19H12ClFN4O2/c20-15-3-1-2-13(7-15)18-23-19(27-24-18)14-4-5-17(26)25(11-14)10-12-6-16(21)9-22-8-12/h1-9,11H,10H2
InChIKeyUVYDPLXMQJMHRN-UHFFFAOYSA-N
MW382.78 g/mol
LogP3.80
Rot. Bonds4

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

5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one (PubChem CID 166850657) has the molecular formula C19H12ClFN4O2 and a molecular weight of 382.78 g/mol. Its IUPAC name is 5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one.

Molecular Properties

Compound Name5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one
PubChem CID166850657
Molecular FormulaC19H12ClFN4O2
Molecular Weight382.78 g/mol
Exact Mass382.06
IUPAC Name5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one
SMILESO=c1ccc(-c2nc(-c3cccc(Cl)c3)no2)cn1Cc1cncc(F)c1
InChIInChI=1S/C19H12ClFN4O2/c20-15-3-1-2-13(7-15)18-23-19(27-24-18)14-4-5-17(26)25(11-14)10-12-6-16(21)9-22-8-12/h1-9,11H,10H2
InChIKeyUVYDPLXMQJMHRN-UHFFFAOYSA-N
XLogP3.80
TPSA73.81 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.78
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Analyze 5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-(pyrimidin-5-ylmethyl)pyridin-2-one
CID 166850823
5-[3-(2-fluorophenyl)-1,2,4-oxadiazol-5-yl]-1-(pyridin-3-ylmethyl)pyridin-2-one
CID 166850879
2-[5-[3-(3-bromophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]-N-(3-chlorophenyl)acetamide
CID 51366667
6-[5-(3-chlorophenyl)-1,2,4-thiadiazol-3-yl]-2-[(5-fluoro-3-pyridinyl)methyl]pyridazin-3-one
CID 168893319
[4-[[3-[5-(3-chlorophenyl)-1,2,4-oxadiazol-3-yl]phenyl]methyl]piperazin-1-yl]-(3,5-difluorophenyl)methanone
CID 46099889
5-(3-chlorophenyl)-3-(4-chlorophenyl)-1,2,4-oxadiazole
CID 17370674
3-(3-chlorophenyl)-5-(4-methoxyphenyl)-1,2,4-oxadiazole
CID 102175113
1-[(4-methylphenyl)methyl]-5-[3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl]pyridin-2-one
CID 86712164
2-[5-[3-(4-chlorophenyl)-1,2,4-oxadiazol-5-yl]-2-oxo-1-pyridinyl]-N-ethyl-N-(3-methylphenyl)acetamide
CID 53132567
1-[[3-(2-methoxyethoxy)phenyl]methyl]-5-[5-(4-methoxyphenyl)-1,2,4-oxadiazol-3-yl]pyridin-2-one
CID 73332715
1-[[3-(2-hydroxypropan-2-yl)phenyl]methyl]-5-[5-[4-(trifluoromethylsulfonyl)phenyl]-1,2,4-oxadiazol-3-yl]pyridin-2-one
CID 73331650
1-[(3-prop-2-enoxyphenyl)methyl]-5-[3-[4-(trifluoromethoxy)phenyl]-1,2,4-oxadiazol-5-yl]pyridin-2-one
CID 86712188

Frequently Asked Questions

What is the IUPAC name of 5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one?
The IUPAC name of 5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one (CID 166850657) is 5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one.
What is the SMILES notation for 5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one?
The canonical SMILES for 5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one is O=c1ccc(-c2nc(-c3cccc(Cl)c3)no2)cn1Cc1cncc(F)c1.
What is the InChIKey of 5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one?
The InChIKey is UVYDPLXMQJMHRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12ClFN4O2/c20-15-3-1-2-13(7-15)18-23-19(27-24-18)14-4-5-17(26)25(11-14)10-12-6-16(21)9-22-8-12/h1-9,11H,10H2.
What are the key properties of 5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one?
5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one has a molecular weight of 382.78 g/mol, XLogP of 3.80, 4 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[3-(3-chlorophenyl)-1,2,4-oxadiazol-5-yl]-1-[(5-fluoro-3-pyridinyl)methyl]pyridin-2-one is sourced from PubChem (CID 166850657), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).