2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole

C15H10F2N8O — CID 169450108

IUPAC2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole
SMILESFC(F)c1nnc(-c2ccc(Cn3nnc(-c4ccccn4)n3)nc2)o1
InChIInChI=1S/C15H10F2N8O/c16-12(17)15-22-21-14(26-15)9-4-5-10(19-7-9)8-25-23-13(20-24-25)11-3-1-2-6-18-11/h1-7,12H,8H2
InChIKeyZTVLPDLCENUSAG-UHFFFAOYSA-N
MW356.30 g/mol
LogP2.17
Rot. Bonds5

About 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole

2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole (PubChem CID 169450108) has the molecular formula C15H10F2N8O and a molecular weight of 356.30 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole
PubChem CID169450108
Molecular FormulaC15H10F2N8O
Molecular Weight356.30 g/mol
Exact Mass356.09
IUPAC Name2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole
SMILESFC(F)c1nnc(-c2ccc(Cn3nnc(-c4ccccn4)n3)nc2)o1
InChIInChI=1S/C15H10F2N8O/c16-12(17)15-22-21-14(26-15)9-4-5-10(19-7-9)8-25-23-13(20-24-25)11-3-1-2-6-18-11/h1-7,12H,8H2
InChIKeyZTVLPDLCENUSAG-UHFFFAOYSA-N
XLogP2.17
TPSA108.30 Ų
H-Bond Donors
H-Bond Acceptors9
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.30
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 109

Analyze 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole with MolForge

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Related Compounds

US10464911, Example 33
CID 126507917
US10464911, Example 52
CID 126509209
5-[1-[[5-[5-(Difluoromethyl)-1,3,4-oxadiazol-2-yl]-3-fluoro-2-pyridinyl]methyl]triazol-4-yl]pyridin-2-amine
CID 162721876
5-(1-((5-(5-(difluoromethyl)-1,3,4-oxadiazol-2-yl)pyridin-2-yl)methyl)-1H-1,2,3-triazol-4-yl)pyridin-2-amine
CID 162721935
2-(Difluoromethyl)-5-[6-[(4-imidazo[1,2-b]pyridazin-3-yltriazol-1-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole
CID 162722076
5-(1-(1-(5-(5-(difluoromethyl)-1,3,4-oxadiazol-2-yl)pyridin-2-yl)ethyl)-1H-1,2,3-triazol-4-yl)pyridin-2-amine
CID 162722116
7'-(2-((5-(5-(difluoromethyl)-1,3,4-oxadiazol-2-yl)pyridin-2-yl)methyl)-2H-tetrazol-5-yl)-1',4'-dihydro-3'H-spiro[cyclopentane-1,2'-quinoxalin]-3'-one
CID 162722200
5-[2-[[4-[5-(Difluoromethyl)-1,3,4-oxadiazol-2-yl]phenyl]methyl]tetrazol-5-yl]-2-methylpyridin-3-amine
CID 162722282
5-(1-((5-(5-(difluoromethyl)-1,3,4-oxadiazol-2-yl)pyridin-2-yl)methyl)-1H-pyrazol-4-yl)pyridin-2-amine
CID 162722416
5-[2-[[4-[5-(Difluoromethyl)-1,3,4-oxadiazol-2-yl]phenyl]methyl]tetrazol-5-yl]pyridin-3-amine
CID 162722473
6-[2-[[5-[5-(Difluoromethyl)-1,3,4-oxadiazol-2-yl]-2-pyridinyl]methyl]tetrazol-5-yl]-2,3-dihydroisoindol-1-one
CID 162722513
(3-(2-((5-(5-(difluoromethyl)-1,3,4-oxadiazol-2-yl)pyridin-2-yl)methyl)-2H-tetrazol-5-yl)phenyl)(morpholino)methanone
CID 162722522

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole?
The IUPAC name of 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole (CID 169450108) is 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole?
The canonical SMILES for 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole is FC(F)c1nnc(-c2ccc(Cn3nnc(-c4ccccn4)n3)nc2)o1.
What is the InChIKey of 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole?
The InChIKey is ZTVLPDLCENUSAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N8O/c16-12(17)15-22-21-14(26-15)9-4-5-10(19-7-9)8-25-23-13(20-24-25)11-3-1-2-6-18-11/h1-7,12H,8H2.
What are the key properties of 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole?
2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole has a molecular weight of 356.30 g/mol, XLogP of 2.17, 5 rotatable bonds, 0 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-[6-[(5-pyridin-2-yltetrazol-2-yl)methyl]-3-pyridinyl]-1,3,4-oxadiazole is sourced from PubChem (CID 169450108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).