2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile

C19H15F2N5O2 — CID 169192702

IUPAC2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile
SMILESN#Cc1cc(-c2nc(N3CCc4ccccc43)no2)cnc1OC(CF)CF
InChIInChI=1S/C19H15F2N5O2/c20-8-15(9-21)27-17-13(10-22)7-14(11-23-17)18-24-19(25-28-18)26-6-5-12-3-1-2-4-16(12)26/h1-4,7,11,15H,5-6,8-9H2
InChIKeyVGIDZGWYPKDJSY-UHFFFAOYSA-N
MW383.36 g/mol
LogP3.38
Rot. Bonds6

About 2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile

2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile (PubChem CID 169192702) has the molecular formula C19H15F2N5O2 and a molecular weight of 383.36 g/mol. Its IUPAC name is 2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile
PubChem CID169192702
Molecular FormulaC19H15F2N5O2
Molecular Weight383.36 g/mol
Exact Mass383.12
IUPAC Name2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile
SMILESN#Cc1cc(-c2nc(N3CCc4ccccc43)no2)cnc1OC(CF)CF
InChIInChI=1S/C19H15F2N5O2/c20-8-15(9-21)27-17-13(10-22)7-14(11-23-17)18-24-19(25-28-18)26-6-5-12-3-1-2-4-16(12)26/h1-4,7,11,15H,5-6,8-9H2
InChIKeyVGIDZGWYPKDJSY-UHFFFAOYSA-N
XLogP3.38
TPSA88.07 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.36
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile?
The IUPAC name of 2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile (CID 169192702) is 2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile.
What is the SMILES notation for 2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile?
The canonical SMILES for 2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile is N#Cc1cc(-c2nc(N3CCc4ccccc43)no2)cnc1OC(CF)CF.
What is the InChIKey of 2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile?
The InChIKey is VGIDZGWYPKDJSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15F2N5O2/c20-8-15(9-21)27-17-13(10-22)7-14(11-23-17)18-24-19(25-28-18)26-6-5-12-3-1-2-4-16(12)26/h1-4,7,11,15H,5-6,8-9H2.
What are the key properties of 2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile?
2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile has a molecular weight of 383.36 g/mol, XLogP of 3.38, 6 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-difluoropropan-2-yloxy)-5-[3-(2,3-dihydroindol-1-yl)-1,2,4-oxadiazol-5-yl]pyridine-3-carbonitrile is sourced from PubChem (CID 169192702), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).