5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine

C11H8N4OS — CID 116525595

IUPAC5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine
SMILESNc1ccc(Oc2ncns2)c2cccnc12
InChIInChI=1S/C11H8N4OS/c12-8-3-4-9(16-11-14-6-15-17-11)7-2-1-5-13-10(7)8/h1-6H,12H2
InChIKeySTRCLCLRYAFHQA-UHFFFAOYSA-N
MW244.28 g/mol
LogP2.46
Rot. Bonds2

About 5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine

5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine (PubChem CID 116525595) has the molecular formula C11H8N4OS and a molecular weight of 244.28 g/mol. Its IUPAC name is 5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine.

Molecular Properties

Compound Name5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine
PubChem CID116525595
Molecular FormulaC11H8N4OS
Molecular Weight244.28 g/mol
Exact Mass244.04
IUPAC Name5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine
SMILESNc1ccc(Oc2ncns2)c2cccnc12
InChIInChI=1S/C11H8N4OS/c12-8-3-4-9(16-11-14-6-15-17-11)7-2-1-5-13-10(7)8/h1-6H,12H2
InChIKeySTRCLCLRYAFHQA-UHFFFAOYSA-N
XLogP2.46
TPSA73.92 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.28
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-(2,1-benzothiazol-3-yloxy)quinolin-8-amine
CID 116525566
5-(2-iodophenoxy)quinolin-8-amine
CID 43479572
5-(4-chlorophenoxy)quinolin-8-amine
CID 43449608
5-(5-fluoropyrimidin-2-yl)oxyquinolin-8-amine
CID 116525609
5-(5-chloropyrimidin-2-yl)oxyquinolin-8-amine
CID 116525568
5-(2,4,5-trichlorophenoxy)quinolin-8-amine
CID 43449630
8-[(3-tert-butyl-1,2,4-thiadiazol-5-yl)oxy]quinolin-5-amine
CID 65274127
5-propan-2-yloxyquinolin-8-amine
CID 43449641
5-(pyrimidin-2-ylmethoxy)quinolin-8-amine
CID 116524814
5-(methoxymethoxy)quinolin-8-amine
CID 116524711
5-[(2-methyl-4-pyridinyl)oxy]quinolin-8-amine
CID 116525610
5-(4-chloro-2,6-dimethylphenoxy)quinolin-8-amine
CID 43449591

Frequently Asked Questions

What is the IUPAC name of 5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine?
The IUPAC name of 5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine (CID 116525595) is 5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine.
What is the SMILES notation for 5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine?
The canonical SMILES for 5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine is Nc1ccc(Oc2ncns2)c2cccnc12.
What is the InChIKey of 5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine?
The InChIKey is STRCLCLRYAFHQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H8N4OS/c12-8-3-4-9(16-11-14-6-15-17-11)7-2-1-5-13-10(7)8/h1-6H,12H2.
What are the key properties of 5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine?
5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine has a molecular weight of 244.28 g/mol, XLogP of 2.46, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1,2,4-thiadiazol-5-yloxy)quinolin-8-amine is sourced from PubChem (CID 116525595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).