3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine

C13H19N7 — CID 141405870

IUPAC3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine
SMILESCCn1nc(C2CCNCC2)nc1-c1nccnc1N
InChIInChI=1S/C13H19N7/c1-2-20-13(10-11(14)17-8-7-16-10)18-12(19-20)9-3-5-15-6-4-9/h7-9,15H,2-6H2,1H3,(H2,14,17)
InChIKeyAZUMBYWOADLRHX-UHFFFAOYSA-N
MW273.34 g/mol
LogP0.80
Rot. Bonds3

About 3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine

3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine (PubChem CID 141405870) has the molecular formula C13H19N7 and a molecular weight of 273.34 g/mol. Its IUPAC name is 3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine.

Molecular Properties

Compound Name3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine
PubChem CID141405870
Molecular FormulaC13H19N7
Molecular Weight273.34 g/mol
Exact Mass273.17
IUPAC Name3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine
SMILESCCn1nc(C2CCNCC2)nc1-c1nccnc1N
InChIInChI=1S/C13H19N7/c1-2-20-13(10-11(14)17-8-7-16-10)18-12(19-20)9-3-5-15-6-4-9/h7-9,15H,2-6H2,1H3,(H2,14,17)
InChIKeyAZUMBYWOADLRHX-UHFFFAOYSA-N
XLogP0.80
TPSA94.54 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 50.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

3-cyclopropyl-1,5-diethyl-1,2,4-triazole
CID 134468971
5-ethyl-2-piperidin-4-ylpyrimidine
CID 83697990
methane;5-methyl-2-piperidin-4-ylpyrimidine
CID 157310053
5-methylsulfonyl-2-piperidin-4-ylpyrimidin-4-amine
CID 82380609
1-[4-[5-[5-amino-6-(5-tert-butyl-1,3,4-oxadiazol-2-yl)pyrazin-2-yl]-1-ethyl-1,2,4-triazol-3-yl]piperidin-1-yl]-1-hydroxypropan-2-one
CID 90303269
ethane;7-piperidin-4-ylisoquinolin-1-amine
CID 91457940
5-piperidin-4-ylpyrimidine-2,4-diamine
CID 22461017
2-piperidin-4-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 84671641
3-(4-cyclopropyl-1,2,4-triazol-3-yl)pyrazin-2-amine
CID 63260133
4-(1-ethyl-4-methylimidazol-2-yl)piperidine
CID 82463366
6-ethyl-2-pyrrolidin-3-yl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 84785460
2,4-dimethyl-6-piperidin-4-yl-1,3,5-triazine
CID 82468969

Frequently Asked Questions

What is the IUPAC name of 3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine?
The IUPAC name of 3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine (CID 141405870) is 3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine.
What is the SMILES notation for 3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine?
The canonical SMILES for 3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine is CCn1nc(C2CCNCC2)nc1-c1nccnc1N.
What is the InChIKey of 3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine?
The InChIKey is AZUMBYWOADLRHX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N7/c1-2-20-13(10-11(14)17-8-7-16-10)18-12(19-20)9-3-5-15-6-4-9/h7-9,15H,2-6H2,1H3,(H2,14,17).
What are the key properties of 3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine?
3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine has a molecular weight of 273.34 g/mol, XLogP of 0.80, 3 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-ethyl-5-piperidin-4-yl-1,2,4-triazol-3-yl)pyrazin-2-amine is sourced from PubChem (CID 141405870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).