ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine

C7H14N4 — CID 143170711

IUPACethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCC.c1nc2n(n1)CCNC2
InChIInChI=1S/C5H8N4.C2H6/c1-2-9-5(3-6-1)7-4-8-9;1-2/h4,6H,1-3H2;1-2H3
InChIKeyQRJWJPRVOXWEFE-UHFFFAOYSA-N
MW154.22 g/mol
LogP0.41
Rot. Bonds

About ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine

ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine (PubChem CID 143170711) has the molecular formula C7H14N4 and a molecular weight of 154.22 g/mol. Its IUPAC name is ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine.

Molecular Properties

Compound Nameethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
PubChem CID143170711
Molecular FormulaC7H14N4
Molecular Weight154.22 g/mol
Exact Mass154.12
IUPAC Nameethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
SMILESCC.c1nc2n(n1)CCNC2
InChIInChI=1S/C5H8N4.C2H6/c1-2-9-5(3-6-1)7-4-8-9;1-2/h4,6H,1-3H2;1-2H3
InChIKeyQRJWJPRVOXWEFE-UHFFFAOYSA-N
XLogP0.41
TPSA42.74 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.22
LogP ≤ 50.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[1,5-a][1,4]diazepine
CID 68900615
6-methyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
CID 171035213
5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine
CID 13247046
5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridine
CID 15496061
7-(azetidin-3-yl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;hydrochloride
CID 130643847
2-methylpropane;5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine
CID 145392855
5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyrazine;dihydrochloride
CID 71463622
3-propan-2-yl-4,5,6,7-tetrahydropyrazolo[1,5-a]pyrazine
CID 144863048
2-bromo-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine;hydrochloride
CID 134500266
7-deuterio-6,7,8,9-tetrahydro-5H-[1,2,4]triazolo[1,5-a]azepine
CID 126576746
2-(difluoromethyl)-5,6,7,8-tetrahydroimidazo[1,2-a]pyrazine;fluoromethane
CID 112757182
7-(piperidin-4-ylmethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine;hydrochloride
CID 120848588

Frequently Asked Questions

What is the IUPAC name of ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
The IUPAC name of ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine (CID 143170711) is ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine.
What is the SMILES notation for ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
The canonical SMILES for ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine is CC.c1nc2n(n1)CCNC2.
What is the InChIKey of ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
The InChIKey is QRJWJPRVOXWEFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4.C2H6/c1-2-9-5(3-6-1)7-4-8-9;1-2/h4,6H,1-3H2;1-2H3.
What are the key properties of ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine?
ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine has a molecular weight of 154.22 g/mol, XLogP of 0.41, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine is sourced from PubChem (CID 143170711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).