6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride

C11H18Cl2N4 — CID 138675012

IUPAC6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride
SMILESCl.Cl.Nc1ccc(C2CC3CCC(C2)N3)nn1
InChIInChI=1S/C11H16N4.2ClH/c12-11-4-3-10(14-15-11)7-5-8-1-2-9(6-7)13-8;;/h3-4,7-9,13H,1-2,5-6H2,(H2,12,15);2*1H
InChIKeyJQBGWYMUYPBUAN-UHFFFAOYSA-N
MW277.20 g/mol
LogP1.90
Rot. Bonds1

About 6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride

6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride (PubChem CID 138675012) has the molecular formula C11H18Cl2N4 and a molecular weight of 277.20 g/mol. Its IUPAC name is 6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride.

Molecular Properties

Compound Name6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride
PubChem CID138675012
Molecular FormulaC11H18Cl2N4
Molecular Weight277.20 g/mol
Exact Mass276.09
IUPAC Name6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride
SMILESCl.Cl.Nc1ccc(C2CC3CCC(C2)N3)nn1
InChIInChI=1S/C11H16N4.2ClH/c12-11-4-3-10(14-15-11)7-5-8-1-2-9(6-7)13-8;;/h3-4,7-9,13H,1-2,5-6H2,(H2,12,15);2*1H
InChIKeyJQBGWYMUYPBUAN-UHFFFAOYSA-N
XLogP1.90
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.20
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-(Pyrrolidin-2-yl)pyridazin-3-amine
CID 117105722
4-Piperidin-4-yl-6-(trifluoromethyl)pyridazin-3-amine
CID 69283231
8-ethyl-N-(6-phenyl-5-propylpyridazin-3-yl)-8-azabicyclo[3.2.1]octan-3-amine
CID 44211534
N-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)methyl]-6-(trifluoromethyl)pyridazin-3-amine
CID 81836664
N,N-dimethyl-6-(piperidin-4-ylmethyl)pyridazin-3-amine
CID 66510119
3-(Piperidin-3-ylmethyl)-6-pyrrolidin-1-ylpyridazine
CID 110271257
5,6,12-Triazatricyclo[7.2.1.02,7]dodeca-2,4,6-trien-4-ylhydrazine
CID 23453900
6-(1-Methyl-piperidin-4-yl)-pyridazin-3-ylamine
CID 66742514
8-(6-Methylpyridazin-3-yl)-3-propan-2-yl-8-azabicyclo[3.2.1]octane
CID 67965416
6-(1,2,3,4-Tetrahydropyridin-4-yl)pyridazin-3-amine
CID 68297937
6-Pyrrolidin-3-ylpyridazin-3-amine
CID 117105039
6-(4-Piperidinyl)-3-pyridazinamine
CID 117105175

Frequently Asked Questions

What is the IUPAC name of 6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride?
The IUPAC name of 6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride (CID 138675012) is 6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride.
What is the SMILES notation for 6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride?
The canonical SMILES for 6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride is Cl.Cl.Nc1ccc(C2CC3CCC(C2)N3)nn1.
What is the InChIKey of 6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride?
The InChIKey is JQBGWYMUYPBUAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4.2ClH/c12-11-4-3-10(14-15-11)7-5-8-1-2-9(6-7)13-8;;/h3-4,7-9,13H,1-2,5-6H2,(H2,12,15);2*1H.
What are the key properties of 6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride?
6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride has a molecular weight of 277.20 g/mol, XLogP of 1.90, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(8-azabicyclo[3.2.1]octan-3-yl)pyridazin-3-amine;dihydrochloride is sourced from PubChem (CID 138675012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).