8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

C17H20N6O — CID 82555302

IUPAC8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCOc1ccccc1N1CCN(c2cccn3nc(N)nc23)CC1
InChIInChI=1S/C17H20N6O/c1-24-15-7-3-2-5-13(15)21-9-11-22(12-10-21)14-6-4-8-23-16(14)19-17(18)20-23/h2-8H,9-12H2,1H3,(H2,18,20)
InChIKeyZBCCNNSCAXJKPA-UHFFFAOYSA-N
MW324.39 g/mol
LogP1.65
Rot. Bonds3

About 8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine

8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (PubChem CID 82555302) has the molecular formula C17H20N6O and a molecular weight of 324.39 g/mol. Its IUPAC name is 8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.

Molecular Properties

Compound Name8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
PubChem CID82555302
Molecular FormulaC17H20N6O
Molecular Weight324.39 g/mol
Exact Mass324.17
IUPAC Name8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine
SMILESCOc1ccccc1N1CCN(c2cccn3nc(N)nc23)CC1
InChIInChI=1S/C17H20N6O/c1-24-15-7-3-2-5-13(15)21-9-11-22(12-10-21)14-6-4-8-23-16(14)19-17(18)20-23/h2-8H,9-12H2,1H3,(H2,18,20)
InChIKeyZBCCNNSCAXJKPA-UHFFFAOYSA-N
XLogP1.65
TPSA71.92 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.39
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

6,7-dimethoxy-2-[4-(2-methoxyphenyl)piperazin-1-yl]quinazolin-4-amine
CID 3076908
1-ethynyl-4-(2-methoxyphenyl)piperazine
CID 67760707
1-(2-methoxyphenyl)-4-nitrosopiperazine
CID 154814146
1-(2-methoxyphenyl)piperidin-4-amine
CID 24708477
1-(chloromethyl)-4-(2-methoxyphenyl)piperazine
CID 19434771
5-[4-(2-methoxyphenyl)piperazin-1-yl]-1,3-dimethylpyrazolo[5,4-d][1,3]thiazole
CID 72918037
4-[[4-(2-methoxyphenyl)piperazin-1-yl]methyl]-1,3-thiazol-2-amine
CID 43216810
4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylpyrimidine
CID 155823172
16-(2-methoxyphenyl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 86134682
4-[4-(2-methoxyphenyl)piperazin-1-yl]-2-methylpyrazolo[1,5-a]pyrazine
CID 133487895
3-[4-(2-methoxyphenyl)piperazin-1-yl]-1H-pyridazine-6-thione
CID 50743559
3-[4-(2-methoxyphenyl)piperazin-1-yl]propan-1-amine
CID 10467259

Frequently Asked Questions

What is the IUPAC name of 8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The IUPAC name of 8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine (CID 82555302) is 8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine.
What is the SMILES notation for 8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The canonical SMILES for 8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is COc1ccccc1N1CCN(c2cccn3nc(N)nc23)CC1.
What is the InChIKey of 8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
The InChIKey is ZBCCNNSCAXJKPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N6O/c1-24-15-7-3-2-5-13(15)21-9-11-22(12-10-21)14-6-4-8-23-16(14)19-17(18)20-23/h2-8H,9-12H2,1H3,(H2,18,20).
What are the key properties of 8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine?
8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine has a molecular weight of 324.39 g/mol, XLogP of 1.65, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 8-[4-(2-methoxyphenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyridin-2-amine is sourced from PubChem (CID 82555302), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).