1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone

C8H7N3O — CID 83873004

IUPAC1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone
SMILESCC(=O)c1ccn2ncnc2c1
InChIInChI=1S/C8H7N3O/c1-6(12)7-2-3-11-8(4-7)9-5-10-11/h2-5H,1H3
InChIKeyUMSXFGGLEJPZLA-UHFFFAOYSA-N
MW161.16 g/mol
LogP0.93
Rot. Bonds1

About 1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone

1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone (PubChem CID 83873004) has the molecular formula C8H7N3O and a molecular weight of 161.16 g/mol. Its IUPAC name is 1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone.

Molecular Properties

Compound Name1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone
PubChem CID83873004
Molecular FormulaC8H7N3O
Molecular Weight161.16 g/mol
Exact Mass161.06
IUPAC Name1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone
SMILESCC(=O)c1ccn2ncnc2c1
InChIInChI=1S/C8H7N3O/c1-6(12)7-2-3-11-8(4-7)9-5-10-11/h2-5H,1H3
InChIKeyUMSXFGGLEJPZLA-UHFFFAOYSA-N
XLogP0.93
TPSA47.26 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 50.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-(7-Methyl-3-phenylpyrazolo[1,5-a]pyrimidin-6-yl)ethanone
CID 641891
1-(7-Methyl-2-phenylpyrazolo[1,5-a]pyrimidin-6-yl)ethanone
CID 708078
Mls002693968
CID 253289
2-Phenyl[1,2,4]triazolo[1,5-a]pyridine-8-carboxamide
CID 44549510
1-[7-Methyl-2-(4-methylphenyl)pyrazolo[1,5-a]pyrimidin-6-yl]ethanone
CID 684290
2-[6-tert-Butyl-4-(3,3-difluoro-pyrrolidin-1-yl)-pyrazolo[3,4-d]pyrimidin-1-yl]-1-pyridin-4-yl-ethanone
CID 85468859
[1,2,3,4]Tetrazolo[1,5-a]pyridine-7-carboxylic acid
CID 37134651
1-[6-(Tetrazol-1-yl)-3-pyridinyl]ethanone
CID 118225265
[1,2,4]Triazolo[1,5-a]pyridine-7-carboxylic acid
CID 51358230
[1,2,4]Triazolo[1,5-a]pyridine-7-carbaldehyde
CID 55296584
(1,2,4)Triazolo(4,3-a)pyridine-7-carboxylic acid
CID 57415877
1-Methyl-1H-pyrazolo[3,4-b]pyridine-3-carbaldehyde
CID 57978088

Frequently Asked Questions

What is the IUPAC name of 1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone?
The IUPAC name of 1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone (CID 83873004) is 1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone.
What is the SMILES notation for 1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone?
The canonical SMILES for 1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone is CC(=O)c1ccn2ncnc2c1.
What is the InChIKey of 1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone?
The InChIKey is UMSXFGGLEJPZLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O/c1-6(12)7-2-3-11-8(4-7)9-5-10-11/h2-5H,1H3.
What are the key properties of 1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone?
1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone has a molecular weight of 161.16 g/mol, XLogP of 0.93, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-([1,2,4]triazolo[1,5-a]pyridin-7-yl)ethanone is sourced from PubChem (CID 83873004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).