ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+)

C8H15N4Rb — CID 145106885

IUPACethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+)
SMILESCC.Cc1nc2n(n1)CC[N-]C2.[Rb+]
InChIInChI=1S/C6H9N4.C2H6.Rb/c1-5-8-6-4-7-2-3-10(6)9-5;1-2;/h2-4H2,1H3;1-2H3;/q-1;;+1
InChIKeyCTGVNKOWUGDVIV-UHFFFAOYSA-N
MW252.70 g/mol
LogP-1.50
Rot. Bonds

About ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+)

ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+) (PubChem CID 145106885) has the molecular formula C8H15N4Rb and a molecular weight of 252.70 g/mol. Its IUPAC name is ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+).

Molecular Properties

Compound Nameethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+)
PubChem CID145106885
Molecular FormulaC8H15N4Rb
Molecular Weight252.70 g/mol
Exact Mass252.04
IUPAC Nameethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+)
SMILESCC.Cc1nc2n(n1)CC[N-]C2.[Rb+]
InChIInChI=1S/C6H9N4.C2H6.Rb/c1-5-8-6-4-7-2-3-10(6)9-5;1-2;/h2-4H2,1H3;1-2H3;/q-1;;+1
InChIKeyCTGVNKOWUGDVIV-UHFFFAOYSA-N
XLogP-1.50
TPSA44.81 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.70
LogP ≤ 5-1.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+) with MolForge

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Related Compounds

5H,6H,7H,8H-(1,2,4)triazolo(1,5-a)pyrazine
CID 18406919
2-methyl-5H,6H,7H,8H-(1,2,4)triazolo(1,5-a)pyrazine
CID 18406955
7-methyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
CID 70214013
5H,6H,7H,8H-[1,2,4]triazolo[1,5-a]pyrazin-2-amine
CID 83872309
1-[(1-butyl-3-methyl-1H-1,2,4-triazol-5-yl)methyl]-4-ethylpiperazine
CID 129615362
3-(Trifluoromethyl)-7-methyl-5,6,7,8-tetrahydro-1,2,4-triazolo[4,3-a]pyrazine
CID 45097024
7-propan-2-yl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
CID 57531006
2-(Fluoromethyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyrazine
CID 57586056
8-methyl-7-propan-2-yl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
CID 57917048
7-ethyl-3-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine
CID 58157198
7-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
CID 67978731
7-tert-butyl-2-(trifluoromethyl)-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazine
CID 70937970

Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+)?
The IUPAC name of ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+) (CID 145106885) is ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+).
What is the SMILES notation for ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+)?
The canonical SMILES for ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+) is CC.Cc1nc2n(n1)CC[N-]C2.[Rb+].
What is the InChIKey of ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+)?
The InChIKey is CTGVNKOWUGDVIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N4.C2H6.Rb/c1-5-8-6-4-7-2-3-10(6)9-5;1-2;/h2-4H2,1H3;1-2H3;/q-1;;+1.
What are the key properties of ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+)?
ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+) has a molecular weight of 252.70 g/mol, XLogP of -1.50, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-6,8-dihydro-5H-[1,2,4]triazolo[1,5-a]pyrazin-7-ide;rubidium(1+) is sourced from PubChem (CID 145106885), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).