1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone

C19H14FN5O2 — CID 146842871

IUPAC1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone
SMILESCc1nc2c(C(=O)Cc3ccccn3)cc(Oc3cncc(F)c3)cn2n1
InChIInChI=1S/C19H14FN5O2/c1-12-23-19-17(18(26)7-14-4-2-3-5-22-14)8-16(11-25(19)24-12)27-15-6-13(20)9-21-10-15/h2-6,8-11H,7H2,1H3
InChIKeySGMJHMLJPDAOSX-UHFFFAOYSA-N
MW363.35 g/mol
LogP3.18
Rot. Bonds5

About 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone

1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone (PubChem CID 146842871) has the molecular formula C19H14FN5O2 and a molecular weight of 363.35 g/mol. Its IUPAC name is 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone.

Molecular Properties

Compound Name1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone
PubChem CID146842871
Molecular FormulaC19H14FN5O2
Molecular Weight363.35 g/mol
Exact Mass363.11
IUPAC Name1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone
SMILESCc1nc2c(C(=O)Cc3ccccn3)cc(Oc3cncc(F)c3)cn2n1
InChIInChI=1S/C19H14FN5O2/c1-12-23-19-17(18(26)7-14-4-2-3-5-22-14)8-16(11-25(19)24-12)27-15-6-13(20)9-21-10-15/h2-6,8-11H,7H2,1H3
InChIKeySGMJHMLJPDAOSX-UHFFFAOYSA-N
XLogP3.18
TPSA82.27 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.35
LogP ≤ 53.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone?
The IUPAC name of 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone (CID 146842871) is 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone.
What is the SMILES notation for 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone?
The canonical SMILES for 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone is Cc1nc2c(C(=O)Cc3ccccn3)cc(Oc3cncc(F)c3)cn2n1.
What is the InChIKey of 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone?
The InChIKey is SGMJHMLJPDAOSX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14FN5O2/c1-12-23-19-17(18(26)7-14-4-2-3-5-22-14)8-16(11-25(19)24-12)27-15-6-13(20)9-21-10-15/h2-6,8-11H,7H2,1H3.
What are the key properties of 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone?
1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone has a molecular weight of 363.35 g/mol, XLogP of 3.18, 5 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[6-[(5-fluoro-3-pyridinyl)oxy]-2-methyl-[1,2,4]triazolo[1,5-a]pyridin-8-yl]-2-pyridin-2-ylethanone is sourced from PubChem (CID 146842871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).