N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine

C7H10N6 — CID 125425135

IUPACN'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine
SMILESNCCNc1ccc2nncn2n1
InChIInChI=1S/C7H10N6/c8-3-4-9-6-1-2-7-11-10-5-13(7)12-6/h1-2,5H,3-4,8H2,(H,9,12)
InChIKeyBUVOGVMILRRJFJ-UHFFFAOYSA-N
MW178.20 g/mol
LogP-0.51
Rot. Bonds3

About N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine

N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine (PubChem CID 125425135) has the molecular formula C7H10N6 and a molecular weight of 178.20 g/mol. Its IUPAC name is N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine
PubChem CID125425135
Molecular FormulaC7H10N6
Molecular Weight178.20 g/mol
Exact Mass178.10
IUPAC NameN'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine
SMILESNCCNc1ccc2nncn2n1
InChIInChI=1S/C7H10N6/c8-3-4-9-6-1-2-7-11-10-5-13(7)12-6/h1-2,5H,3-4,8H2,(H,9,12)
InChIKeyBUVOGVMILRRJFJ-UHFFFAOYSA-N
XLogP-0.51
TPSA81.13 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.20
LogP ≤ 5-0.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine?
The IUPAC name of N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine (CID 125425135) is N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine.
What is the SMILES notation for N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine?
The canonical SMILES for N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine is NCCNc1ccc2nncn2n1.
What is the InChIKey of N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine?
The InChIKey is BUVOGVMILRRJFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N6/c8-3-4-9-6-1-2-7-11-10-5-13(7)12-6/h1-2,5H,3-4,8H2,(H,9,12).
What are the key properties of N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine?
N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine has a molecular weight of 178.20 g/mol, XLogP of -0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N'-([1,2,4]triazolo[4,3-b]pyridazin-6-yl)ethane-1,2-diamine is sourced from PubChem (CID 125425135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).