6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine

C9H12N4 — CID 142345359

IUPAC6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine
SMILESCCc1cc(C)c2nnc(C)n2n1
InChIInChI=1S/C9H12N4/c1-4-8-5-6(2)9-11-10-7(3)13(9)12-8/h5H,4H2,1-3H3
InChIKeyWLKQFIPRECIJIY-UHFFFAOYSA-N
MW176.22 g/mol
LogP1.30
Rot. Bonds1

About 6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine

6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine (PubChem CID 142345359) has the molecular formula C9H12N4 and a molecular weight of 176.22 g/mol. Its IUPAC name is 6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine.

Molecular Properties

Compound Name6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine
PubChem CID142345359
Molecular FormulaC9H12N4
Molecular Weight176.22 g/mol
Exact Mass176.11
IUPAC Name6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine
SMILESCCc1cc(C)c2nnc(C)n2n1
InChIInChI=1S/C9H12N4/c1-4-8-5-6(2)9-11-10-7(3)13(9)12-8/h5H,4H2,1-3H3
InChIKeyWLKQFIPRECIJIY-UHFFFAOYSA-N
XLogP1.30
TPSA43.08 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.22
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

6-iodo-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 134516677
2-ethyl-7-methylpyrazolo[1,5-a]pyridine
CID 143123624
6-[1-ethyl-3-[(1R,2R)-2-(1-methylpyrazol-4-yl)cyclopropyl]pyrazol-5-yl]-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 178158842
6-[1-ethyl-3-[2-(1-ethylpyrazol-4-yl)cyclopropyl]pyrazol-5-yl]-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 178159098
3,6-dimethyl-[1,2,4]triazolo[3,4-a]phthalazine
CID 13185783
6-butan-2-yl-3,7-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 134516560
3,5-diethylpyrazole-1-carboxamide
CID 91622965
8-methyl-6-pentan-3-yloxy-[1,2,4]triazolo[4,3-b]pyridazin-3-amine
CID 58045902
6-(3,5-diethylpyrazol-1-yl)-5-methylpyridine-3-carbaldehyde
CID 82694898
3-ethyl-5-methyl-1-propan-2-ylpyrazole
CID 58977189
N-(6-chloro-3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-8-yl)-2-ethylbutanamide
CID 142345363
5,7-dichloro-2-ethylpyrazolo[1,5-a]pyrimidine
CID 112694464

Frequently Asked Questions

What is the IUPAC name of 6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine?
The IUPAC name of 6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine (CID 142345359) is 6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine.
What is the SMILES notation for 6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine?
The canonical SMILES for 6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine is CCc1cc(C)c2nnc(C)n2n1.
What is the InChIKey of 6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine?
The InChIKey is WLKQFIPRECIJIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N4/c1-4-8-5-6(2)9-11-10-7(3)13(9)12-8/h5H,4H2,1-3H3.
What are the key properties of 6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine?
6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine has a molecular weight of 176.22 g/mol, XLogP of 1.30, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-ethyl-3,8-dimethyl-[1,2,4]triazolo[4,3-b]pyridazine is sourced from PubChem (CID 142345359), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).