N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide

C16H10FN7O2 — CID 118096900

IUPACN-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
SMILESO=C(Nc1ccc(F)cn1)c1cc(Oc2cncnc2)cn2ncnc12
InChIInChI=1S/C16H10FN7O2/c17-10-1-2-14(20-4-10)23-16(25)13-3-11(7-24-15(13)21-9-22-24)26-12-5-18-8-19-6-12/h1-9H,(H,20,23,25)
InChIKeyCBMXXEDRQZKTGZ-UHFFFAOYSA-N
MW351.30 g/mol
LogP2.10
Rot. Bonds4

About N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide

N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide (PubChem CID 118096900) has the molecular formula C16H10FN7O2 and a molecular weight of 351.30 g/mol. Its IUPAC name is N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide.

Molecular Properties

Compound NameN-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
PubChem CID118096900
Molecular FormulaC16H10FN7O2
Molecular Weight351.30 g/mol
Exact Mass351.09
IUPAC NameN-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
SMILESO=C(Nc1ccc(F)cn1)c1cc(Oc2cncnc2)cn2ncnc12
InChIInChI=1S/C16H10FN7O2/c17-10-1-2-14(20-4-10)23-16(25)13-3-11(7-24-15(13)21-9-22-24)26-12-5-18-8-19-6-12/h1-9H,(H,20,23,25)
InChIKeyCBMXXEDRQZKTGZ-UHFFFAOYSA-N
XLogP2.10
TPSA107.19 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500351.30
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The IUPAC name of N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide (CID 118096900) is N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide.
What is the SMILES notation for N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The canonical SMILES for N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide is O=C(Nc1ccc(F)cn1)c1cc(Oc2cncnc2)cn2ncnc12.
What is the InChIKey of N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
The InChIKey is CBMXXEDRQZKTGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10FN7O2/c17-10-1-2-14(20-4-10)23-16(25)13-3-11(7-24-15(13)21-9-22-24)26-12-5-18-8-19-6-12/h1-9H,(H,20,23,25).
What are the key properties of N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide?
N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide has a molecular weight of 351.30 g/mol, XLogP of 2.10, 4 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-fluoro-2-pyridinyl)-6-pyrimidin-5-yloxy-[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide is sourced from PubChem (CID 118096900), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).