3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine

C11H14N4 — CID 169123970

IUPAC3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine
SMILESCc1nnc(-c2ccn(C)n2)c(C)c1C
InChIInChI=1S/C11H14N4/c1-7-8(2)11(13-12-9(7)3)10-5-6-15(4)14-10/h5-6H,1-4H3
InChIKeyDMBMOVMRHPLZNZ-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.80
Rot. Bonds1

About 3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine

3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine (PubChem CID 169123970) has the molecular formula C11H14N4 and a molecular weight of 202.26 g/mol. Its IUPAC name is 3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine.

Molecular Properties

Compound Name3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine
PubChem CID169123970
Molecular FormulaC11H14N4
Molecular Weight202.26 g/mol
Exact Mass202.12
IUPAC Name3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine
SMILESCc1nnc(-c2ccn(C)n2)c(C)c1C
InChIInChI=1S/C11H14N4/c1-7-8(2)11(13-12-9(7)3)10-5-6-15(4)14-10/h5-6H,1-4H3
InChIKeyDMBMOVMRHPLZNZ-UHFFFAOYSA-N
XLogP1.80
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine?
The IUPAC name of 3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine (CID 169123970) is 3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine.
What is the SMILES notation for 3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine?
The canonical SMILES for 3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine is Cc1nnc(-c2ccn(C)n2)c(C)c1C.
What is the InChIKey of 3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine?
The InChIKey is DMBMOVMRHPLZNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N4/c1-7-8(2)11(13-12-9(7)3)10-5-6-15(4)14-10/h5-6H,1-4H3.
What are the key properties of 3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine?
3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine has a molecular weight of 202.26 g/mol, XLogP of 1.80, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5-trimethyl-6-(1-methylpyrazol-3-yl)pyridazine is sourced from PubChem (CID 169123970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).