2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole

C15H10F2N6O2 — CID 169290226

IUPAC2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole
SMILESFC(F)c1nnc(-c2ccc(COc3nccn4ccnc34)nc2)o1
InChIInChI=1S/C15H10F2N6O2/c16-11(17)14-22-21-13(25-14)9-1-2-10(20-7-9)8-24-15-12-18-3-5-23(12)6-4-19-15/h1-7,11H,8H2
InChIKeyKAELHLVSWKYDRN-UHFFFAOYSA-N
MW344.28 g/mol
LogP2.69
Rot. Bonds5

About 2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole

2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole (PubChem CID 169290226) has the molecular formula C15H10F2N6O2 and a molecular weight of 344.28 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole.

Molecular Properties

Compound Name2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole
PubChem CID169290226
Molecular FormulaC15H10F2N6O2
Molecular Weight344.28 g/mol
Exact Mass344.08
IUPAC Name2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole
SMILESFC(F)c1nnc(-c2ccc(COc3nccn4ccnc34)nc2)o1
InChIInChI=1S/C15H10F2N6O2/c16-11(17)14-22-21-13(25-14)9-1-2-10(20-7-9)8-24-15-12-18-3-5-23(12)6-4-19-15/h1-7,11H,8H2
InChIKeyKAELHLVSWKYDRN-UHFFFAOYSA-N
XLogP2.69
TPSA91.23 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.28
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole?
The IUPAC name of 2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole (CID 169290226) is 2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole.
What is the SMILES notation for 2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole?
The canonical SMILES for 2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole is FC(F)c1nnc(-c2ccc(COc3nccn4ccnc34)nc2)o1.
What is the InChIKey of 2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole?
The InChIKey is KAELHLVSWKYDRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10F2N6O2/c16-11(17)14-22-21-13(25-14)9-1-2-10(20-7-9)8-24-15-12-18-3-5-23(12)6-4-19-15/h1-7,11H,8H2.
What are the key properties of 2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole?
2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole has a molecular weight of 344.28 g/mol, XLogP of 2.69, 5 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-[6-(imidazo[1,2-a]pyrazin-8-yloxymethyl)-3-pyridinyl]-1,3,4-oxadiazole is sourced from PubChem (CID 169290226), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).