5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine

C7H6BrN3S — CID 130055583

IUPAC5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine
SMILESCc1cc(Br)nc2sc(N)nc12
InChIInChI=1S/C7H6BrN3S/c1-3-2-4(8)10-6-5(3)11-7(9)12-6/h2H,1H3,(H2,9,11)
InChIKeyIMYNJTVLUPKOJG-UHFFFAOYSA-N
MW244.12 g/mol
LogP2.34
Rot. Bonds

About 5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine

5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine (PubChem CID 130055583) has the molecular formula C7H6BrN3S and a molecular weight of 244.12 g/mol. Its IUPAC name is 5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine.

Molecular Properties

Compound Name5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine
PubChem CID130055583
Molecular FormulaC7H6BrN3S
Molecular Weight244.12 g/mol
Exact Mass242.95
IUPAC Name5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine
SMILESCc1cc(Br)nc2sc(N)nc12
InChIInChI=1S/C7H6BrN3S/c1-3-2-4(8)10-6-5(3)11-7(9)12-6/h2H,1H3,(H2,9,11)
InChIKeyIMYNJTVLUPKOJG-UHFFFAOYSA-N
XLogP2.34
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.12
LogP ≤ 52.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

6-Bromo-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 44612774
5-Bromo-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 45789977
5-Methyl-(1,3)thiazolo(5,4-b)pyridin-2-amine
CID 58015366
CID 91756213
CID 91756213
7-Bromo-(1,3)thiazolo(4,5-c)pyridin-2-amine
CID 112756629
5-Fluorothiazolo[5,4-b]pyridin-2-amine
CID 23160371
5-(Methylaminomethyl)-7-(trifluoromethyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 169993043
5-Bromo-6-fluoro-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 171486881
5-(4-Fluorophenyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 172224362
2-Phenyl-[1,3]thiazolo[5,4-b]pyridin-5-amine
CID 162412296
CID 91756002
CID 91756002
5-(Trifluoromethyl)-[1,3]thiazolo[5,4-b]pyridin-2-amine
CID 91757041

Frequently Asked Questions

What is the IUPAC name of 5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The IUPAC name of 5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine (CID 130055583) is 5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine.
What is the SMILES notation for 5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The canonical SMILES for 5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine is Cc1cc(Br)nc2sc(N)nc12.
What is the InChIKey of 5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The InChIKey is IMYNJTVLUPKOJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H6BrN3S/c1-3-2-4(8)10-6-5(3)11-7(9)12-6/h2H,1H3,(H2,9,11).
What are the key properties of 5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine?
5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine has a molecular weight of 244.12 g/mol, XLogP of 2.34, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-bromo-7-methyl-[1,3]thiazolo[5,4-b]pyridin-2-amine is sourced from PubChem (CID 130055583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).