5-quinolin-6-yloxythiatriazole

C10H6N4OS — CID 116820231

IUPAC5-quinolin-6-yloxythiatriazole
SMILESc1cnc2ccc(Oc3nnns3)cc2c1
InChIInChI=1S/C10H6N4OS/c1-2-7-6-8(3-4-9(7)11-5-1)15-10-12-13-14-16-10/h1-6H
InChIKeyXLLCOIQEXSRHGQ-UHFFFAOYSA-N
MW230.25 g/mol
LogP2.27
Rot. Bonds2

About 5-quinolin-6-yloxythiatriazole

5-quinolin-6-yloxythiatriazole (PubChem CID 116820231) has the molecular formula C10H6N4OS and a molecular weight of 230.25 g/mol. Its IUPAC name is 5-quinolin-6-yloxythiatriazole.

Molecular Properties

Compound Name5-quinolin-6-yloxythiatriazole
PubChem CID116820231
Molecular FormulaC10H6N4OS
Molecular Weight230.25 g/mol
Exact Mass230.03
IUPAC Name5-quinolin-6-yloxythiatriazole
SMILESc1cnc2ccc(Oc3nnns3)cc2c1
InChIInChI=1S/C10H6N4OS/c1-2-7-6-8(3-4-9(7)11-5-1)15-10-12-13-14-16-10/h1-6H
InChIKeyXLLCOIQEXSRHGQ-UHFFFAOYSA-N
XLogP2.27
TPSA60.79 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.25
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

6-[4-(chloromethyl)phenoxy]quinoline
CID 82093013
6-[(2-methylpropan-2-yl)oxy]quinoline
CID 59854598
ethene;6-methoxyquinoline
CID 174599262
6-quinolin-6-yloxypyridin-2-amine
CID 45139860
6-phosphorosooxyquinoline
CID 21130862
quinolin-6-yl formate
CID 57289431
6-prop-2-enoxyquinoline
CID 21107330
6-quinolin-6-yloxypyridine-2-carbonitrile
CID 133392287
1-quinolin-6-yloxypropan-2-amine
CID 86262441
3-chloro-4-quinolin-6-yloxyaniline
CID 13490789
6-(azetidin-3-yloxy)quinoline;hydrochloride
CID 86262635
quinolin-6-yl methanesulfonate
CID 157288502

Frequently Asked Questions

What is the IUPAC name of 5-quinolin-6-yloxythiatriazole?
The IUPAC name of 5-quinolin-6-yloxythiatriazole (CID 116820231) is 5-quinolin-6-yloxythiatriazole.
What is the SMILES notation for 5-quinolin-6-yloxythiatriazole?
The canonical SMILES for 5-quinolin-6-yloxythiatriazole is c1cnc2ccc(Oc3nnns3)cc2c1.
What is the InChIKey of 5-quinolin-6-yloxythiatriazole?
The InChIKey is XLLCOIQEXSRHGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H6N4OS/c1-2-7-6-8(3-4-9(7)11-5-1)15-10-12-13-14-16-10/h1-6H.
What are the key properties of 5-quinolin-6-yloxythiatriazole?
5-quinolin-6-yloxythiatriazole has a molecular weight of 230.25 g/mol, XLogP of 2.27, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-quinolin-6-yloxythiatriazole is sourced from PubChem (CID 116820231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).