2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide

C19H12F2N4O2S — CID 24876237

IUPAC2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide
SMILESCc1cc(-c2nnco2)sc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1
InChIInChI=1S/C19H12F2N4O2S/c1-10-7-14(19-25-23-9-27-19)28-17(10)11-5-6-15(22-8-11)24-18(26)16-12(20)3-2-4-13(16)21/h2-9H,1H3,(H,22,24,26)
InChIKeyVZDOQVKFDKBJBE-UHFFFAOYSA-N
MW398.39 g/mol
LogP4.70
Rot. Bonds4

About 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide

2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide (PubChem CID 24876237) has the molecular formula C19H12F2N4O2S and a molecular weight of 398.39 g/mol. Its IUPAC name is 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide
PubChem CID24876237
Molecular FormulaC19H12F2N4O2S
Molecular Weight398.39 g/mol
Exact Mass398.06
IUPAC Name2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide
SMILESCc1cc(-c2nnco2)sc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1
InChIInChI=1S/C19H12F2N4O2S/c1-10-7-14(19-25-23-9-27-19)28-17(10)11-5-6-15(22-8-11)24-18(26)16-12(20)3-2-4-13(16)21/h2-9H,1H3,(H,22,24,26)
InChIKeyVZDOQVKFDKBJBE-UHFFFAOYSA-N
XLogP4.70
TPSA80.91 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500398.39
LogP ≤ 54.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide with MolForge

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Related Compounds

5-[3-(2-fluorophenyl)-1-methylpyrazol-5-yl]-N-(3-fluoro-2-pyridinyl)thiophene-2-carboxamide
CID 68062166
N-(3-fluoro-2-pyridinyl)-5-(1-methyl-3-phenylpyrazol-5-yl)thiophene-2-carboxamide
CID 68062187
US9499502, 27bp-a
CID 89095120
US9499502, 27bp-b
CID 90137902
US9868738, Example 42
CID 118974617
5-(5-((4-(5-(difluoromethyl)-1,3,4-oxadiazol-2-yl)phenyl)thio)-4-methyl-4H-1,2,4-triazol-3-yl)pyridin-2-amine
CID 162722568
2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-pyridin-2-ylacetamide
CID 934123
2-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(pyridin-2-ylcarbamoyl)acetamide
CID 172459629
2-[[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(pyridin-2-ylcarbamoyl)acetamide
CID 172460173
2-[[5-(3-methylphenyl)-1,3,4-oxadiazol-2-yl]sulfanyl]-N-(pyridin-2-ylcarbamoyl)acetamide
CID 172468166
2-[(5-phenyl-1,3,4-oxadiazol-2-yl)sulfanyl]-N-(pyridin-2-ylcarbamoyl)acetamide
CID 172469484
2-{[5-(3-fluorophenyl)-1,3,4-oxadiazol-2-yl]sulfanyl}-N-(pyridin-2-yl)acetamide
CID 851346

Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide?
The IUPAC name of 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide (CID 24876237) is 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide.
What is the SMILES notation for 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide?
The canonical SMILES for 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide is Cc1cc(-c2nnco2)sc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.
What is the InChIKey of 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide?
The InChIKey is VZDOQVKFDKBJBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H12F2N4O2S/c1-10-7-14(19-25-23-9-27-19)28-17(10)11-5-6-15(22-8-11)24-18(26)16-12(20)3-2-4-13(16)21/h2-9H,1H3,(H,22,24,26).
What are the key properties of 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide?
2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide has a molecular weight of 398.39 g/mol, XLogP of 4.70, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[5-[3-methyl-5-(1,3,4-oxadiazol-2-yl)thiophen-2-yl]-2-pyridinyl]benzamide is sourced from PubChem (CID 24876237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).