6-methyl-5-piperazin-1-yl-1,2,4-triazine

C8H13N5 — CID 116823260

IUPAC6-methyl-5-piperazin-1-yl-1,2,4-triazine
SMILESCc1nncnc1N1CCNCC1
InChIInChI=1S/C8H13N5/c1-7-8(10-6-11-12-7)13-4-2-9-3-5-13/h6,9H,2-5H2,1H3
InChIKeyMUOKKARHKLSVQR-UHFFFAOYSA-N
MW179.23 g/mol
LogP-0.41
Rot. Bonds1

About 6-methyl-5-piperazin-1-yl-1,2,4-triazine

6-methyl-5-piperazin-1-yl-1,2,4-triazine (PubChem CID 116823260) has the molecular formula C8H13N5 and a molecular weight of 179.23 g/mol. Its IUPAC name is 6-methyl-5-piperazin-1-yl-1,2,4-triazine.

Molecular Properties

Compound Name6-methyl-5-piperazin-1-yl-1,2,4-triazine
PubChem CID116823260
Molecular FormulaC8H13N5
Molecular Weight179.23 g/mol
Exact Mass179.12
IUPAC Name6-methyl-5-piperazin-1-yl-1,2,4-triazine
SMILESCc1nncnc1N1CCNCC1
InChIInChI=1S/C8H13N5/c1-7-8(10-6-11-12-7)13-4-2-9-3-5-13/h6,9H,2-5H2,1H3
InChIKeyMUOKKARHKLSVQR-UHFFFAOYSA-N
XLogP-0.41
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.23
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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1-(3-methyl-2-pyridinyl)piperazine
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1-(3-ethyl-5-methyl-2-pyridinyl)piperazine
CID 58484627
1-methyl-4-piperazin-1-ylpyrazolo[5,4-d]pyrimidine
CID 11356415
1-(2-methyl-3-pyridinyl)piperazine;dihydrochloride
CID 70057644
5-iodo-4-piperazin-1-ylpyrimidine;dihydrochloride
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3-methyl-4-piperazin-1-yl-1,2,5-oxadiazole;hydrochloride
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Frequently Asked Questions

What is the IUPAC name of 6-methyl-5-piperazin-1-yl-1,2,4-triazine?
The IUPAC name of 6-methyl-5-piperazin-1-yl-1,2,4-triazine (CID 116823260) is 6-methyl-5-piperazin-1-yl-1,2,4-triazine.
What is the SMILES notation for 6-methyl-5-piperazin-1-yl-1,2,4-triazine?
The canonical SMILES for 6-methyl-5-piperazin-1-yl-1,2,4-triazine is Cc1nncnc1N1CCNCC1.
What is the InChIKey of 6-methyl-5-piperazin-1-yl-1,2,4-triazine?
The InChIKey is MUOKKARHKLSVQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5/c1-7-8(10-6-11-12-7)13-4-2-9-3-5-13/h6,9H,2-5H2,1H3.
What are the key properties of 6-methyl-5-piperazin-1-yl-1,2,4-triazine?
6-methyl-5-piperazin-1-yl-1,2,4-triazine has a molecular weight of 179.23 g/mol, XLogP of -0.41, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-5-piperazin-1-yl-1,2,4-triazine is sourced from PubChem (CID 116823260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).