6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine

C10H10BrN3S — CID 138718669

IUPAC6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine
SMILESBrc1cnc2nc(N3CCCC3)sc2c1
InChIInChI=1S/C10H10BrN3S/c11-7-5-8-9(12-6-7)13-10(15-8)14-3-1-2-4-14/h5-6H,1-4H2
InChIKeySOYJFDXGYAMCRW-UHFFFAOYSA-N
MW284.18 g/mol
LogP3.05
Rot. Bonds1

About 6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine

6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine (PubChem CID 138718669) has the molecular formula C10H10BrN3S and a molecular weight of 284.18 g/mol. Its IUPAC name is 6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine.

Molecular Properties

Compound Name6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine
PubChem CID138718669
Molecular FormulaC10H10BrN3S
Molecular Weight284.18 g/mol
Exact Mass282.98
IUPAC Name6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine
SMILESBrc1cnc2nc(N3CCCC3)sc2c1
InChIInChI=1S/C10H10BrN3S/c11-7-5-8-9(12-6-7)13-10(15-8)14-3-1-2-4-14/h5-6H,1-4H2
InChIKeySOYJFDXGYAMCRW-UHFFFAOYSA-N
XLogP3.05
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.18
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

bis(6-bromo-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine);2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine
CID 160688497
2-morpholin-4-yl-[1,3]thiazolo[4,5-b]pyridin-6-amine
CID 118224190
6-bromo-2-chloro-[1,3]thiazolo[4,5-b]pyridine;hydrochloride
CID 67462755
ethyl 2-(azetidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine-6-carboxylate
CID 138688419
6-(4-methylphenyl)-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine
CID 58579706
1-[2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]propan-2-one
CID 58579665
6-(5-methyl-3-pyridinyl)-2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridine
CID 58579712
N-[2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]cyclopentanecarboxamide
CID 58579700
4-[2-(4-piperidin-1-ylpiperidin-1-yl)-[1,3]thiazolo[4,5-b]pyridin-6-yl]benzonitrile
CID 45482708
2-piperidin-1-yl-[1,3]thiazolo[4,5-c]pyridine-6-carboxylic acid
CID 135386900
4-([1,3]thiazolo[4,5-d]pyrimidin-2-yl)morpholine
CID 123685077
2-pyrrolidin-1-yl-1,3-thiazol-5-amine
CID 66520588

Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine?
The IUPAC name of 6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine (CID 138718669) is 6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine.
What is the SMILES notation for 6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine?
The canonical SMILES for 6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine is Brc1cnc2nc(N3CCCC3)sc2c1.
What is the InChIKey of 6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine?
The InChIKey is SOYJFDXGYAMCRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN3S/c11-7-5-8-9(12-6-7)13-10(15-8)14-3-1-2-4-14/h5-6H,1-4H2.
What are the key properties of 6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine?
6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine has a molecular weight of 284.18 g/mol, XLogP of 3.05, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-pyrrolidin-1-yl-[1,3]thiazolo[4,5-b]pyridine is sourced from PubChem (CID 138718669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).