5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine

C16H20N8 — CID 133304100

IUPAC5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine
SMILESCCc1cc(N2CCN(c3ccc(N)nc3)CC2)n2ncnc2n1
InChIInChI=1S/C16H20N8/c1-2-12-9-15(24-16(21-12)19-11-20-24)23-7-5-22(6-8-23)13-3-4-14(17)18-10-13/h3-4,9-11H,2,5-8H2,1H3,(H2,17,18)
InChIKeyBHCYFZLGSQABIA-UHFFFAOYSA-N
MW324.39 g/mol
LogP0.99
Rot. Bonds3

About 5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine

5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine (PubChem CID 133304100) has the molecular formula C16H20N8 and a molecular weight of 324.39 g/mol. Its IUPAC name is 5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine.

Molecular Properties

Compound Name5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine
PubChem CID133304100
Molecular FormulaC16H20N8
Molecular Weight324.39 g/mol
Exact Mass324.18
IUPAC Name5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine
SMILESCCc1cc(N2CCN(c3ccc(N)nc3)CC2)n2ncnc2n1
InChIInChI=1S/C16H20N8/c1-2-12-9-15(24-16(21-12)19-11-20-24)23-7-5-22(6-8-23)13-3-4-14(17)18-10-13/h3-4,9-11H,2,5-8H2,1H3,(H2,17,18)
InChIKeyBHCYFZLGSQABIA-UHFFFAOYSA-N
XLogP0.99
TPSA88.47 Ų
H-Bond Donors1
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.39
LogP ≤ 50.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 108

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Related Compounds

5-[4-[5-(methoxymethyl)-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl]piperazin-1-yl]pyridin-2-amine
CID 133304099
5-ethyl-7-[4-(4-fluorophenyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine
CID 50820542
5-ethyl-7-[4-(1-phenylethyl)piperazin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine
CID 46094621
7-[4-[(4-tert-butylphenyl)methyl]piperazin-1-yl]-5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidine
CID 46096770
ethyl 1-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperidine-4-carboxylate
CID 46094525
N-(4-chlorophenyl)-2-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]acetamide
CID 133418014
5-[4-(2-methylbutyl)piperazin-1-yl]pyridin-2-amine
CID 62104206
5-ethyl-7-[4-[(4-fluorophenyl)methoxy]piperidin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine
CID 133422121
5-ethyl-7-[4-(2-iodophenoxy)piperidin-1-yl]-[1,2,4]triazolo[1,5-a]pyrimidine
CID 133337359
5-[4-(3-ethyl-1,2,4-thiadiazol-5-yl)piperazin-1-yl]pyridin-2-amine
CID 65275971
5-[4-(4-chlorophenyl)piperazin-1-yl]pyridin-2-amine
CID 43318150
[(2S)-1-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)pyrrolidin-2-yl]methanol
CID 95296940

Frequently Asked Questions

What is the IUPAC name of 5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine?
The IUPAC name of 5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine (CID 133304100) is 5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine.
What is the SMILES notation for 5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine?
The canonical SMILES for 5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine is CCc1cc(N2CCN(c3ccc(N)nc3)CC2)n2ncnc2n1.
What is the InChIKey of 5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine?
The InChIKey is BHCYFZLGSQABIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N8/c1-2-12-9-15(24-16(21-12)19-11-20-24)23-7-5-22(6-8-23)13-3-4-14(17)18-10-13/h3-4,9-11H,2,5-8H2,1H3,(H2,17,18).
What are the key properties of 5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine?
5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine has a molecular weight of 324.39 g/mol, XLogP of 0.99, 3 rotatable bonds, 1 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-(5-ethyl-[1,2,4]triazolo[1,5-a]pyrimidin-7-yl)piperazin-1-yl]pyridin-2-amine is sourced from PubChem (CID 133304100), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).