6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile

C12H6FN5O — CID 118103986

IUPAC6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
SMILESN#Cc1cc(Oc2cncc(F)c2)cn2ncnc12
InChIInChI=1S/C12H6FN5O/c13-9-2-10(5-15-4-9)19-11-1-8(3-14)12-16-7-17-18(12)6-11/h1-2,4-7H
InChIKeyZSVNGJUXLUUJLE-UHFFFAOYSA-N
MW255.21 g/mol
LogP1.93
Rot. Bonds2

About 6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile

6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (PubChem CID 118103986) has the molecular formula C12H6FN5O and a molecular weight of 255.21 g/mol. Its IUPAC name is 6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile.

Molecular Properties

Compound Name6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
PubChem CID118103986
Molecular FormulaC12H6FN5O
Molecular Weight255.21 g/mol
Exact Mass255.06
IUPAC Name6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile
SMILESN#Cc1cc(Oc2cncc(F)c2)cn2ncnc12
InChIInChI=1S/C12H6FN5O/c13-9-2-10(5-15-4-9)19-11-1-8(3-14)12-16-7-17-18(12)6-11/h1-2,4-7H
InChIKeyZSVNGJUXLUUJLE-UHFFFAOYSA-N
XLogP1.93
TPSA76.10 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.21
LogP ≤ 51.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The IUPAC name of 6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile (CID 118103986) is 6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile.
What is the SMILES notation for 6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The canonical SMILES for 6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile is N#Cc1cc(Oc2cncc(F)c2)cn2ncnc12.
What is the InChIKey of 6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
The InChIKey is ZSVNGJUXLUUJLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H6FN5O/c13-9-2-10(5-15-4-9)19-11-1-8(3-14)12-16-7-17-18(12)6-11/h1-2,4-7H.
What are the key properties of 6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile?
6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile has a molecular weight of 255.21 g/mol, XLogP of 1.93, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-fluoro-3-pyridinyl)oxy]-[1,2,4]triazolo[1,5-a]pyridine-8-carbonitrile is sourced from PubChem (CID 118103986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).