2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine

C12H16N2S — CID 59820187

IUPAC2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine
SMILESCC(C)c1cnc2nc(C(C)C)sc2c1
InChIInChI=1S/C12H16N2S/c1-7(2)9-5-10-11(13-6-9)14-12(15-10)8(3)4/h5-8H,1-4H3
InChIKeyQTOYWKORZBANEX-UHFFFAOYSA-N
MW220.34 g/mol
LogP3.94
Rot. Bonds2

About 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine

2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine (PubChem CID 59820187) has the molecular formula C12H16N2S and a molecular weight of 220.34 g/mol. Its IUPAC name is 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine.

Molecular Properties

Compound Name2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine
PubChem CID59820187
Molecular FormulaC12H16N2S
Molecular Weight220.34 g/mol
Exact Mass220.10
IUPAC Name2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine
SMILESCC(C)c1cnc2nc(C(C)C)sc2c1
InChIInChI=1S/C12H16N2S/c1-7(2)9-5-10-11(13-6-9)14-12(15-10)8(3)4/h5-8H,1-4H3
InChIKeyQTOYWKORZBANEX-UHFFFAOYSA-N
XLogP3.94
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.34
LogP ≤ 53.94
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-chloro-6-propan-2-yl-[1,3]thiazolo[4,5-b]pyridine
CID 139355626
3,6-di(propan-2-yl)-1,8-naphthyridine
CID 166719717
2-iodo-5-propan-2-ylthieno[2,3-b]pyridine
CID 177170103
2-propan-2-yl-5,6-dihydro-4H-cyclopenta[d][1,3]thiazole;2-propan-2-yl-4,5,6,7-tetrahydro-1,3-benzothiazole;3-propan-2-yl-5,6,7,8-tetrahydroquinoline
CID 158029359
6-propan-2-yl-1,8-naphthyridin-2-amine
CID 155176084
5-(2-methylpropyl)-2-propan-2-yl-1,3-benzothiazole
CID 134533017
6-chloro-2-propan-2-yl-1,3-benzothiazole
CID 18340659
2-propan-2-yl-1,3-benzothiazol-5-amine
CID 69263682
5-methoxy-2-propan-2-yl-1,3-benzothiazol-6-amine
CID 45077485
1-([1,3]thiazolo[4,5-b]pyridin-2-yl)ethanamine
CID 82409429
fluoromethane;bis(2-propan-2-yl-1,3-benzothiazole)
CID 167583467
2-propan-2-yl-[1,3]thiazolo[5,4-d]pyrimidine
CID 58470040

Frequently Asked Questions

What is the IUPAC name of 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine?
The IUPAC name of 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine (CID 59820187) is 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine.
What is the SMILES notation for 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine?
The canonical SMILES for 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine is CC(C)c1cnc2nc(C(C)C)sc2c1.
What is the InChIKey of 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine?
The InChIKey is QTOYWKORZBANEX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2S/c1-7(2)9-5-10-11(13-6-9)14-12(15-10)8(3)4/h5-8H,1-4H3.
What are the key properties of 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine?
2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine has a molecular weight of 220.34 g/mol, XLogP of 3.94, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-di(propan-2-yl)-[1,3]thiazolo[4,5-b]pyridine is sourced from PubChem (CID 59820187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).