N-(1-methylpyrazol-3-yl)pyridazin-3-amine

C8H9N5 — CID 79778792

IUPACN-(1-methylpyrazol-3-yl)pyridazin-3-amine
SMILESCn1ccc(Nc2cccnn2)n1
InChIInChI=1S/C8H9N5/c1-13-6-4-8(12-13)10-7-3-2-5-9-11-7/h2-6H,1H3,(H,10,11,12)
InChIKeyJETQJEZXWWCVTQ-UHFFFAOYSA-N
MW175.19 g/mol
LogP0.95
Rot. Bonds2

About N-(1-methylpyrazol-3-yl)pyridazin-3-amine

N-(1-methylpyrazol-3-yl)pyridazin-3-amine (PubChem CID 79778792) has the molecular formula C8H9N5 and a molecular weight of 175.19 g/mol. Its IUPAC name is N-(1-methylpyrazol-3-yl)pyridazin-3-amine.

Molecular Properties

Compound NameN-(1-methylpyrazol-3-yl)pyridazin-3-amine
PubChem CID79778792
Molecular FormulaC8H9N5
Molecular Weight175.19 g/mol
Exact Mass175.09
IUPAC NameN-(1-methylpyrazol-3-yl)pyridazin-3-amine
SMILESCn1ccc(Nc2cccnn2)n1
InChIInChI=1S/C8H9N5/c1-13-6-4-8(12-13)10-7-3-2-5-9-11-7/h2-6H,1H3,(H,10,11,12)
InChIKeyJETQJEZXWWCVTQ-UHFFFAOYSA-N
XLogP0.95
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.19
LogP ≤ 50.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(1-methylpyrazol-3-yl)pyridazin-3-amine?
The IUPAC name of N-(1-methylpyrazol-3-yl)pyridazin-3-amine (CID 79778792) is N-(1-methylpyrazol-3-yl)pyridazin-3-amine.
What is the SMILES notation for N-(1-methylpyrazol-3-yl)pyridazin-3-amine?
The canonical SMILES for N-(1-methylpyrazol-3-yl)pyridazin-3-amine is Cn1ccc(Nc2cccnn2)n1.
What is the InChIKey of N-(1-methylpyrazol-3-yl)pyridazin-3-amine?
The InChIKey is JETQJEZXWWCVTQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N5/c1-13-6-4-8(12-13)10-7-3-2-5-9-11-7/h2-6H,1H3,(H,10,11,12).
What are the key properties of N-(1-methylpyrazol-3-yl)pyridazin-3-amine?
N-(1-methylpyrazol-3-yl)pyridazin-3-amine has a molecular weight of 175.19 g/mol, XLogP of 0.95, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-methylpyrazol-3-yl)pyridazin-3-amine is sourced from PubChem (CID 79778792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).