6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine

C9H10FN3 — CID 84656862

IUPAC6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCC(C)c1nc2ccc(F)cn2n1
InChIInChI=1S/C9H10FN3/c1-6(2)9-11-8-4-3-7(10)5-13(8)12-9/h3-6H,1-2H3
InChIKeySMSJVFQPXMHZAP-UHFFFAOYSA-N
MW179.20 g/mol
LogP1.99
Rot. Bonds1

About 6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine

6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 84656862) has the molecular formula C9H10FN3 and a molecular weight of 179.20 g/mol. Its IUPAC name is 6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID84656862
Molecular FormulaC9H10FN3
Molecular Weight179.20 g/mol
Exact Mass179.09
IUPAC Name6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine
SMILESCC(C)c1nc2ccc(F)cn2n1
InChIInChI=1S/C9H10FN3/c1-6(2)9-11-8-4-3-7(10)5-13(8)12-9/h3-6H,1-2H3
InChIKeySMSJVFQPXMHZAP-UHFFFAOYSA-N
XLogP1.99
TPSA30.19 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.20
LogP ≤ 51.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine (CID 84656862) is 6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine is CC(C)c1nc2ccc(F)cn2n1.
What is the InChIKey of 6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is SMSJVFQPXMHZAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN3/c1-6(2)9-11-8-4-3-7(10)5-13(8)12-9/h3-6H,1-2H3.
What are the key properties of 6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine?
6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 179.20 g/mol, XLogP of 1.99, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-2-propan-2-yl-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 84656862), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).