1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine

C9H16N6 — CID 69253967

IUPAC1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine
SMILESCCN(CC)n1ccc2c(N)nc(N)n21
InChIInChI=1S/C9H16N6/c1-3-13(4-2)14-6-5-7-8(10)12-9(11)15(7)14/h5-6H,3-4,10H2,1-2H3,(H2,11,12)
InChIKeyAOUDHFGUYGCEPO-UHFFFAOYSA-N
MW208.27 g/mol
LogP0.28
Rot. Bonds3

About 1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine

1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine (PubChem CID 69253967) has the molecular formula C9H16N6 and a molecular weight of 208.27 g/mol. Its IUPAC name is 1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine.

Molecular Properties

Compound Name1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine
PubChem CID69253967
Molecular FormulaC9H16N6
Molecular Weight208.27 g/mol
Exact Mass208.14
IUPAC Name1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine
SMILESCCN(CC)n1ccc2c(N)nc(N)n21
InChIInChI=1S/C9H16N6/c1-3-13(4-2)14-6-5-7-8(10)12-9(11)15(7)14/h5-6H,3-4,10H2,1-2H3,(H2,11,12)
InChIKeyAOUDHFGUYGCEPO-UHFFFAOYSA-N
XLogP0.28
TPSA77.51 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.27
LogP ≤ 50.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine?
The IUPAC name of 1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine (CID 69253967) is 1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine.
What is the SMILES notation for 1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine?
The canonical SMILES for 1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine is CCN(CC)n1ccc2c(N)nc(N)n21.
What is the InChIKey of 1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine?
The InChIKey is AOUDHFGUYGCEPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N6/c1-3-13(4-2)14-6-5-7-8(10)12-9(11)15(7)14/h5-6H,3-4,10H2,1-2H3,(H2,11,12).
What are the key properties of 1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine?
1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine has a molecular weight of 208.27 g/mol, XLogP of 0.28, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-N,1-N-diethylimidazo[1,5-b]pyrazole-1,4,6-triamine is sourced from PubChem (CID 69253967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).