2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine

C6H9N5 — CID 15868718

IUPAC2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine
SMILESCc1nc2c(N)c(C)[nH]n2n1
InChIInChI=1S/C6H9N5/c1-3-5(7)6-8-4(2)10-11(6)9-3/h9H,7H2,1-2H3
InChIKeyLJOQQWKTNLVEQW-UHFFFAOYSA-N
MW151.17 g/mol
LogP0.26
Rot. Bonds

About 2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine

2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine (PubChem CID 15868718) has the molecular formula C6H9N5 and a molecular weight of 151.17 g/mol. Its IUPAC name is 2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine.

Molecular Properties

Compound Name2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine
PubChem CID15868718
Molecular FormulaC6H9N5
Molecular Weight151.17 g/mol
Exact Mass151.09
IUPAC Name2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine
SMILESCc1nc2c(N)c(C)[nH]n2n1
InChIInChI=1S/C6H9N5/c1-3-5(7)6-8-4(2)10-11(6)9-3/h9H,7H2,1-2H3
InChIKeyLJOQQWKTNLVEQW-UHFFFAOYSA-N
XLogP0.26
TPSA72.00 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.17
LogP ≤ 50.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine?
The IUPAC name of 2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine (CID 15868718) is 2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine.
What is the SMILES notation for 2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine?
The canonical SMILES for 2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine is Cc1nc2c(N)c(C)[nH]n2n1.
What is the InChIKey of 2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine?
The InChIKey is LJOQQWKTNLVEQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H9N5/c1-3-5(7)6-8-4(2)10-11(6)9-3/h9H,7H2,1-2H3.
What are the key properties of 2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine?
2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine has a molecular weight of 151.17 g/mol, XLogP of 0.26, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-dimethyl-5H-pyrazolo[1,5-b][1,2,4]triazol-7-amine is sourced from PubChem (CID 15868718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).