N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide

C8H8N4O — CID 53204400

IUPACN-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide
SMILESCC(=O)Nc1nnc2ccccn12
InChIInChI=1S/C8H8N4O/c1-6(13)9-8-11-10-7-4-2-3-5-12(7)8/h2-5H,1H3,(H,9,11,13)
InChIKeyCEFXVVOWSDRCDK-UHFFFAOYSA-N
MW176.18 g/mol
LogP0.69
Rot. Bonds1

About N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide

N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide (PubChem CID 53204400) has the molecular formula C8H8N4O and a molecular weight of 176.18 g/mol. Its IUPAC name is N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide.

Molecular Properties

Compound NameN-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide
PubChem CID53204400
Molecular FormulaC8H8N4O
Molecular Weight176.18 g/mol
Exact Mass176.07
IUPAC NameN-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide
SMILESCC(=O)Nc1nnc2ccccn12
InChIInChI=1S/C8H8N4O/c1-6(13)9-8-11-10-7-4-2-3-5-12(7)8/h2-5H,1H3,(H,9,11,13)
InChIKeyCEFXVVOWSDRCDK-UHFFFAOYSA-N
XLogP0.69
TPSA59.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.18
LogP ≤ 50.69
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide?
The IUPAC name of N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide (CID 53204400) is N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide.
What is the SMILES notation for N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide?
The canonical SMILES for N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide is CC(=O)Nc1nnc2ccccn12.
What is the InChIKey of N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide?
The InChIKey is CEFXVVOWSDRCDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4O/c1-6(13)9-8-11-10-7-4-2-3-5-12(7)8/h2-5H,1H3,(H,9,11,13).
What are the key properties of N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide?
N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide has a molecular weight of 176.18 g/mol, XLogP of 0.69, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-([1,2,4]triazolo[4,3-a]pyridin-3-yl)acetamide is sourced from PubChem (CID 53204400), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).