6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine

C16H10FN5O — CID 162507375

IUPAC6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESFc1ccc(Oc2ncc(-c3ccc4ncnn4c3)cn2)cc1
InChIInChI=1S/C16H10FN5O/c17-13-2-4-14(5-3-13)23-16-18-7-12(8-19-16)11-1-6-15-20-10-21-22(15)9-11/h1-10H
InChIKeyZPUWBABNRKMTLT-UHFFFAOYSA-N
MW307.29 g/mol
LogP3.12
Rot. Bonds3

About 6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine

6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine (PubChem CID 162507375) has the molecular formula C16H10FN5O and a molecular weight of 307.29 g/mol. Its IUPAC name is 6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine.

Molecular Properties

Compound Name6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine
PubChem CID162507375
Molecular FormulaC16H10FN5O
Molecular Weight307.29 g/mol
Exact Mass307.09
IUPAC Name6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine
SMILESFc1ccc(Oc2ncc(-c3ccc4ncnn4c3)cn2)cc1
InChIInChI=1S/C16H10FN5O/c17-13-2-4-14(5-3-13)23-16-18-7-12(8-19-16)11-1-6-15-20-10-21-22(15)9-11/h1-10H
InChIKeyZPUWBABNRKMTLT-UHFFFAOYSA-N
XLogP3.12
TPSA65.20 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.29
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine?
The IUPAC name of 6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine (CID 162507375) is 6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine.
What is the SMILES notation for 6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine?
The canonical SMILES for 6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine is Fc1ccc(Oc2ncc(-c3ccc4ncnn4c3)cn2)cc1.
What is the InChIKey of 6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine?
The InChIKey is ZPUWBABNRKMTLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FN5O/c17-13-2-4-14(5-3-13)23-16-18-7-12(8-19-16)11-1-6-15-20-10-21-22(15)9-11/h1-10H.
What are the key properties of 6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine?
6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine has a molecular weight of 307.29 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-fluorophenoxy)pyrimidin-5-yl]-[1,2,4]triazolo[1,5-a]pyridine is sourced from PubChem (CID 162507375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).