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

C15H13ClN4O2 — CID 53166276

IUPAC2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide
SMILESCOc1ccc(CC(=O)Nc2cccn3cnnc23)c(Cl)c1
InChIInChI=1S/C15H13ClN4O2/c1-22-11-5-4-10(12(16)8-11)7-14(21)18-13-3-2-6-20-9-17-19-15(13)20/h2-6,8-9H,7H2,1H3,(H,18,21)
InChIKeyFWFZCXWSCXDNBD-UHFFFAOYSA-N
MW316.75 g/mol
LogP2.57
Rot. Bonds4

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

2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide (PubChem CID 53166276) has the molecular formula C15H13ClN4O2 and a molecular weight of 316.75 g/mol. Its IUPAC name is 2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide.

Molecular Properties

Compound Name2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide
PubChem CID53166276
Molecular FormulaC15H13ClN4O2
Molecular Weight316.75 g/mol
Exact Mass316.07
IUPAC Name2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide
SMILESCOc1ccc(CC(=O)Nc2cccn3cnnc23)c(Cl)c1
InChIInChI=1S/C15H13ClN4O2/c1-22-11-5-4-10(12(16)8-11)7-14(21)18-13-3-2-6-20-9-17-19-15(13)20/h2-6,8-9H,7H2,1H3,(H,18,21)
InChIKeyFWFZCXWSCXDNBD-UHFFFAOYSA-N
XLogP2.57
TPSA68.52 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.75
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-chloro-4-methoxyphenyl)-N-methylacetamide
CID 18456580
N-(4-acetamidophenyl)-2-(2-chloro-4-methoxyphenyl)acetamide
CID 110770008
2-(2,4-dichlorophenyl)-N-(2,4-dimethoxyphenyl)acetamide
CID 2709356
2-(4-methoxyphenyl)-N-(2-methylimidazo[1,2-a]pyridin-8-yl)acetamide
CID 110735239
2-(2-chloro-4-methoxyphenyl)-N-cyclopropylacetamide
CID 110769934
N-(2-chloro-5-methoxyphenyl)-2-(2-hydroxyphenyl)acetamide
CID 80741109
2-(2-chloro-4-methoxyphenyl)-N-(5-methyl-4-phenyl-1H-pyrazol-3-yl)acetamide
CID 53198503
2-(2-chloro-4-methoxyphenyl)-N-(2-piperidin-1-ylpyrimidin-5-yl)acetamide
CID 53164705
5-chloro-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)thiophene-2-carboxamide
CID 53166273
N-[(2-chloro-4-methoxyphenyl)methyl]-2-sulfanylacetamide
CID 115167187
2-(2-chloro-4-methoxyphenyl)-N,N-diethylacetamide
CID 110769985
1-amino-3-[(2-chloro-4-methoxyphenyl)methyl]urea
CID 115192660

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide?
The IUPAC name of 2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide (CID 53166276) is 2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide.
What is the SMILES notation for 2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide?
The canonical SMILES for 2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide is COc1ccc(CC(=O)Nc2cccn3cnnc23)c(Cl)c1.
What is the InChIKey of 2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide?
The InChIKey is FWFZCXWSCXDNBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClN4O2/c1-22-11-5-4-10(12(16)8-11)7-14(21)18-13-3-2-6-20-9-17-19-15(13)20/h2-6,8-9H,7H2,1H3,(H,18,21).
What are the key properties of 2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide?
2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide has a molecular weight of 316.75 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methoxyphenyl)-N-([1,2,4]triazolo[4,3-a]pyridin-8-yl)acetamide is sourced from PubChem (CID 53166276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).