2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide

C15H14N4O2 — CID 53166259

IUPAC2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide
SMILESCOc1cccc(CC(=O)Nc2cccn3cnnc23)c1
InChIInChI=1S/C15H14N4O2/c1-21-12-5-2-4-11(8-12)9-14(20)17-13-6-3-7-19-10-16-18-15(13)19/h2-8,10H,9H2,1H3,(H,17,20)
InChIKeyPSDCJNTYYZRZSJ-UHFFFAOYSA-N
MW282.30 g/mol
LogP1.92
Rot. Bonds4

About 2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide

2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide (PubChem CID 53166259) has the molecular formula C15H14N4O2 and a molecular weight of 282.30 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide
PubChem CID53166259
Molecular FormulaC15H14N4O2
Molecular Weight282.30 g/mol
Exact Mass282.11
IUPAC Name2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide
SMILESCOc1cccc(CC(=O)Nc2cccn3cnnc23)c1
InChIInChI=1S/C15H14N4O2/c1-21-12-5-2-4-11(8-12)9-14(20)17-13-6-3-7-19-10-16-18-15(13)19/h2-8,10H,9H2,1H3,(H,17,20)
InChIKeyPSDCJNTYYZRZSJ-UHFFFAOYSA-N
XLogP1.92
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.30
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide?
The IUPAC name of 2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide (CID 53166259) is 2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide?
The canonical SMILES for 2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide is COc1cccc(CC(=O)Nc2cccn3cnnc23)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide?
The InChIKey is PSDCJNTYYZRZSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N4O2/c1-21-12-5-2-4-11(8-12)9-14(20)17-13-6-3-7-19-10-16-18-15(13)19/h2-8,10H,9H2,1H3,(H,17,20).
What are the key properties of 2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide?
2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide has a molecular weight of 282.30 g/mol, XLogP of 1.92, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide is sourced from PubChem (CID 53166259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).