2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine

C7H10N6 — CID 130545233

IUPAC2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine
SMILESCC(C)(N)c1ccc2nnnn2n1
InChIInChI=1S/C7H10N6/c1-7(2,8)5-3-4-6-9-11-12-13(6)10-5/h3-4H,8H2,1-2H3
InChIKeyJSHODJBMZVXLDT-UHFFFAOYSA-N
MW178.20 g/mol
LogP-0.29
Rot. Bonds1

About 2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine

2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine (PubChem CID 130545233) has the molecular formula C7H10N6 and a molecular weight of 178.20 g/mol. Its IUPAC name is 2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine.

Molecular Properties

Compound Name2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine
PubChem CID130545233
Molecular FormulaC7H10N6
Molecular Weight178.20 g/mol
Exact Mass178.10
IUPAC Name2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine
SMILESCC(C)(N)c1ccc2nnnn2n1
InChIInChI=1S/C7H10N6/c1-7(2,8)5-3-4-6-9-11-12-13(6)10-5/h3-4H,8H2,1-2H3
InChIKeyJSHODJBMZVXLDT-UHFFFAOYSA-N
XLogP-0.29
TPSA81.99 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.20
LogP ≤ 5-0.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine?
The IUPAC name of 2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine (CID 130545233) is 2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine.
What is the SMILES notation for 2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine?
The canonical SMILES for 2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine is CC(C)(N)c1ccc2nnnn2n1.
What is the InChIKey of 2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine?
The InChIKey is JSHODJBMZVXLDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N6/c1-7(2,8)5-3-4-6-9-11-12-13(6)10-5/h3-4H,8H2,1-2H3.
What are the key properties of 2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine?
2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine has a molecular weight of 178.20 g/mol, XLogP of -0.29, 1 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(tetrazolo[1,5-b]pyridazin-6-yl)propan-2-amine is sourced from PubChem (CID 130545233), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).