3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole

C11H9N3OS — CID 121248052

IUPAC3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole
SMILESCc1noc(C)c1-c1cc2scnc2cn1
InChIInChI=1S/C11H9N3OS/c1-6-11(7(2)15-14-6)8-3-10-9(4-12-8)13-5-16-10/h3-5H,1-2H3
InChIKeyAQRKTHMPFRKWJJ-UHFFFAOYSA-N
MW231.28 g/mol
LogP2.96
Rot. Bonds1

About 3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole

3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole (PubChem CID 121248052) has the molecular formula C11H9N3OS and a molecular weight of 231.28 g/mol. Its IUPAC name is 3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole.

Molecular Properties

Compound Name3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole
PubChem CID121248052
Molecular FormulaC11H9N3OS
Molecular Weight231.28 g/mol
Exact Mass231.05
IUPAC Name3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole
SMILESCc1noc(C)c1-c1cc2scnc2cn1
InChIInChI=1S/C11H9N3OS/c1-6-11(7(2)15-14-6)8-3-10-9(4-12-8)13-5-16-10/h3-5H,1-2H3
InChIKeyAQRKTHMPFRKWJJ-UHFFFAOYSA-N
XLogP2.96
TPSA51.81 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.28
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

3,5-dimethyl-4-([1,3]thiazolo[4,5-b]pyridin-6-yl)-1,2-oxazole
CID 130383084
6-(3,5-dimethyl-1,2-oxazol-4-yl)pyridin-3-amine
CID 130058108
4-(4-tert-butyl-1,3-thiazol-2-yl)-3,5-dimethyl-1,2-oxazole
CID 69116242
4-(5-bromo-3-pyridinyl)-3,5-dimethyl-1,2-oxazole;3,5-dibromopyridine
CID 160862172
(3,5-dimethyl-1,2-oxazol-4-yl)methyl 1,3-benzothiazole-6-carboxylate
CID 7276513
4-(1-benzyl-2-ethoxyimidazo[4,5-c]pyridin-6-yl)-3,5-dimethyl-1,2-oxazole
CID 152547567
3,5-dimethyl-4-[2-(3-methylphenyl)-1,3-thiazol-4-yl]-1,2-oxazole
CID 126793475
[1,3]thiazolo[5,4-g]quinoxaline
CID 45077795
3,5-dimethyl-4-[2-methyl-6-[(2R)-pyrrolidin-2-yl]pyrimidin-4-yl]-1,2-oxazole
CID 124946763
1-benzyl-6-(3,5-dimethyl-1,2-oxazol-4-yl)-N-(oxetan-3-yl)imidazo[4,5-c]pyridin-2-amine
CID 150175991
[2-(3,5-dimethyl-1,2-oxazol-4-yl)-1,3-thiazol-5-yl]methanamine
CID 61280175
5-methyl-[1,3]thiazolo[5,4-d]pyrimidine
CID 592016

Frequently Asked Questions

What is the IUPAC name of 3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole?
The IUPAC name of 3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole (CID 121248052) is 3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole.
What is the SMILES notation for 3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole?
The canonical SMILES for 3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole is Cc1noc(C)c1-c1cc2scnc2cn1.
What is the InChIKey of 3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole?
The InChIKey is AQRKTHMPFRKWJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N3OS/c1-6-11(7(2)15-14-6)8-3-10-9(4-12-8)13-5-16-10/h3-5H,1-2H3.
What are the key properties of 3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole?
3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole has a molecular weight of 231.28 g/mol, XLogP of 2.96, 1 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-dimethyl-4-([1,3]thiazolo[4,5-c]pyridin-6-yl)-1,2-oxazole is sourced from PubChem (CID 121248052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).