7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine

C10H14N4 — CID 163561282

IUPAC7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine
SMILESCCc1nnc(C)c2c(C)nn(C)c12
InChIInChI=1S/C10H14N4/c1-5-8-10-9(6(2)11-12-8)7(3)13-14(10)4/h5H2,1-4H3
InChIKeyFRKKYSLBXSNBHP-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.54
Rot. Bonds1

About 7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine

7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine (PubChem CID 163561282) has the molecular formula C10H14N4 and a molecular weight of 190.25 g/mol. Its IUPAC name is 7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine.

Molecular Properties

Compound Name7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine
PubChem CID163561282
Molecular FormulaC10H14N4
Molecular Weight190.25 g/mol
Exact Mass190.12
IUPAC Name7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine
SMILESCCc1nnc(C)c2c(C)nn(C)c12
InChIInChI=1S/C10H14N4/c1-5-8-10-9(6(2)11-12-8)7(3)13-14(10)4/h5H2,1-4H3
InChIKeyFRKKYSLBXSNBHP-UHFFFAOYSA-N
XLogP1.54
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.54
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine?
The IUPAC name of 7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine (CID 163561282) is 7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine.
What is the SMILES notation for 7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine?
The canonical SMILES for 7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine is CCc1nnc(C)c2c(C)nn(C)c12.
What is the InChIKey of 7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine?
The InChIKey is FRKKYSLBXSNBHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4/c1-5-8-10-9(6(2)11-12-8)7(3)13-14(10)4/h5H2,1-4H3.
What are the key properties of 7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine?
7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine has a molecular weight of 190.25 g/mol, XLogP of 1.54, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-ethyl-1,3,4-trimethylpyrazolo[3,4-d]pyridazine is sourced from PubChem (CID 163561282), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).