7-ethyltetrazolo[1,5-a][1,3,5]triazine

C5H6N6 — CID 156710931

IUPAC7-ethyltetrazolo[1,5-a][1,3,5]triazine
SMILESCCc1ncnc2nnnn12
InChIInChI=1S/C5H6N6/c1-2-4-6-3-7-5-8-9-10-11(4)5/h3H,2H2,1H3
InChIKeyLAADGTVECKZBMJ-UHFFFAOYSA-N
MW150.15 g/mol
LogP-0.52
Rot. Bonds1

About 7-ethyltetrazolo[1,5-a][1,3,5]triazine

7-ethyltetrazolo[1,5-a][1,3,5]triazine (PubChem CID 156710931) has the molecular formula C5H6N6 and a molecular weight of 150.15 g/mol. Its IUPAC name is 7-ethyltetrazolo[1,5-a][1,3,5]triazine.

Molecular Properties

Compound Name7-ethyltetrazolo[1,5-a][1,3,5]triazine
PubChem CID156710931
Molecular FormulaC5H6N6
Molecular Weight150.15 g/mol
Exact Mass150.07
IUPAC Name7-ethyltetrazolo[1,5-a][1,3,5]triazine
SMILESCCc1ncnc2nnnn12
InChIInChI=1S/C5H6N6/c1-2-4-6-3-7-5-8-9-10-11(4)5/h3H,2H2,1H3
InChIKeyLAADGTVECKZBMJ-UHFFFAOYSA-N
XLogP-0.52
TPSA68.86 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.15
LogP ≤ 5-0.52
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 7-ethyltetrazolo[1,5-a][1,3,5]triazine?
The IUPAC name of 7-ethyltetrazolo[1,5-a][1,3,5]triazine (CID 156710931) is 7-ethyltetrazolo[1,5-a][1,3,5]triazine.
What is the SMILES notation for 7-ethyltetrazolo[1,5-a][1,3,5]triazine?
The canonical SMILES for 7-ethyltetrazolo[1,5-a][1,3,5]triazine is CCc1ncnc2nnnn12.
What is the InChIKey of 7-ethyltetrazolo[1,5-a][1,3,5]triazine?
The InChIKey is LAADGTVECKZBMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H6N6/c1-2-4-6-3-7-5-8-9-10-11(4)5/h3H,2H2,1H3.
What are the key properties of 7-ethyltetrazolo[1,5-a][1,3,5]triazine?
7-ethyltetrazolo[1,5-a][1,3,5]triazine has a molecular weight of 150.15 g/mol, XLogP of -0.52, 1 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyltetrazolo[1,5-a][1,3,5]triazine is sourced from PubChem (CID 156710931), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).