5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine

C10H11N7 — CID 16767484

IUPAC5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine
SMILESCc1cc(N)n(-c2ccc3nnc(C)n3n2)n1
InChIInChI=1S/C10H11N7/c1-6-5-8(11)17(14-6)10-4-3-9-13-12-7(2)16(9)15-10/h3-5H,11H2,1-2H3
InChIKeyKOKOLWNCMVDFAP-UHFFFAOYSA-N
MW229.25 g/mol
LogP0.51
Rot. Bonds1

About 5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine

5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine (PubChem CID 16767484) has the molecular formula C10H11N7 and a molecular weight of 229.25 g/mol. Its IUPAC name is 5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine.

Molecular Properties

Compound Name5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine
PubChem CID16767484
Molecular FormulaC10H11N7
Molecular Weight229.25 g/mol
Exact Mass229.11
IUPAC Name5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine
SMILESCc1cc(N)n(-c2ccc3nnc(C)n3n2)n1
InChIInChI=1S/C10H11N7/c1-6-5-8(11)17(14-6)10-4-3-9-13-12-7(2)16(9)15-10/h3-5H,11H2,1-2H3
InChIKeyKOKOLWNCMVDFAP-UHFFFAOYSA-N
XLogP0.51
TPSA86.92 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.25
LogP ≤ 50.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

5,7-Dimethylpyrazolo[1,5-a]pyrimidin-2-amine
CID 28063903
6-(3,5-Dimethylpyrazol-1-yl)-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 909959
6-(3,5-dimethyl-1H-pyrazol-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
CID 702232
LA 2851
CID 68910
3-Methyl-6-(1-pyrrolidinyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 869579
2,5-Dimethylpyrazolo[1,5-a]pyrimidin-7-amine
CID 2768096
Pyrazolo(1,5-a)-1,3,5-triazine-2,4-diamine, 7-methyl-, hydrochloride (1:?)
CID 3054719
2-(3,5-Dimethylpyrazol-1-yl)-5,7-dimethylpyrazolo[1,5-a]pyrimidine
CID 56673919
N-butyl-3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-amine
CID 334712
6-Hydrazinyl-3-methyl-[1,2,4]triazolo[4,3-b]pyridazine
CID 12583717
3-bromo-6-(4-bromo-3,5-dimethyl-1H-pyrazol-1-yl)[1,2,4]triazolo[4,3-b]pyridazine
CID 657747
N2,N7,7-trimethylpyrazolo(1,5-a)pyrimidine-5,7-diamine
CID 125424258

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine?
The IUPAC name of 5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine (CID 16767484) is 5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine.
What is the SMILES notation for 5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine?
The canonical SMILES for 5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine is Cc1cc(N)n(-c2ccc3nnc(C)n3n2)n1.
What is the InChIKey of 5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine?
The InChIKey is KOKOLWNCMVDFAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N7/c1-6-5-8(11)17(14-6)10-4-3-9-13-12-7(2)16(9)15-10/h3-5H,11H2,1-2H3.
What are the key properties of 5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine?
5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine has a molecular weight of 229.25 g/mol, XLogP of 0.51, 1 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(3-methyl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)pyrazol-3-amine is sourced from PubChem (CID 16767484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).