[6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine

C11H11N5S — CID 116822418

IUPAC[6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine
SMILESCc1ccsc1-c1ccc2nnc(CN)n2n1
InChIInChI=1S/C11H11N5S/c1-7-4-5-17-11(7)8-2-3-9-13-14-10(6-12)16(9)15-8/h2-5H,6,12H2,1H3
InChIKeyUVZUTJVVYMBSPX-UHFFFAOYSA-N
MW245.31 g/mol
LogP1.62
Rot. Bonds2

About [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine

[6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine (PubChem CID 116822418) has the molecular formula C11H11N5S and a molecular weight of 245.31 g/mol. Its IUPAC name is [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine.

Molecular Properties

Compound Name[6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine
PubChem CID116822418
Molecular FormulaC11H11N5S
Molecular Weight245.31 g/mol
Exact Mass245.07
IUPAC Name[6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine
SMILESCc1ccsc1-c1ccc2nnc(CN)n2n1
InChIInChI=1S/C11H11N5S/c1-7-4-5-17-11(7)8-2-3-9-13-14-10(6-12)16(9)15-8/h2-5H,6,12H2,1H3
InChIKeyUVZUTJVVYMBSPX-UHFFFAOYSA-N
XLogP1.62
TPSA69.10 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.31
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(6-methyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methanamine
CID 62043689
2-(6-thiophen-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethanamine
CID 82167237
N-methyl-2-(6-thiophen-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)ethanamine
CID 116822351
[6-(3H-benzimidazol-5-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine
CID 116822398
(3-thiophen-2-yl-[1,2,4]triazolo[4,3-b]pyridazin-6-yl)methanamine
CID 90009339
3-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-a]pyridin-6-amine
CID 62538543
2-N-[6-(3-methylthiophen-2-yl)pyridazin-3-yl]propane-1,2-diamine
CID 116970554
[6-(2-triethylsilylethynyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine
CID 141201394
2-[6-(2-methylpropyl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]ethanamine
CID 116822321
acetic acid;(6-methylsulfonyl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methanamine;hydrochloride
CID 138987949
(6-morpholin-4-yl-[1,2,4]triazolo[4,3-b]pyridazin-3-yl)methanamine
CID 13134095
[2-(3-methylthiophen-2-yl)-1,3-thiazol-4-yl]methanamine
CID 61282401

Frequently Asked Questions

What is the IUPAC name of [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine?
The IUPAC name of [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine (CID 116822418) is [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine.
What is the SMILES notation for [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine?
The canonical SMILES for [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine is Cc1ccsc1-c1ccc2nnc(CN)n2n1.
What is the InChIKey of [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine?
The InChIKey is UVZUTJVVYMBSPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11N5S/c1-7-4-5-17-11(7)8-2-3-9-13-14-10(6-12)16(9)15-8/h2-5H,6,12H2,1H3.
What are the key properties of [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine?
[6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine has a molecular weight of 245.31 g/mol, XLogP of 1.62, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-methylthiophen-2-yl)-[1,2,4]triazolo[4,3-b]pyridazin-3-yl]methanamine is sourced from PubChem (CID 116822418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).