6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine

C9H10BrN3O2S — CID 59352792

IUPAC6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine
SMILESCOCCOc1nc2sc(N)nc2cc1Br
InChIInChI=1S/C9H10BrN3O2S/c1-14-2-3-15-7-5(10)4-6-8(13-7)16-9(11)12-6/h4H,2-3H2,1H3,(H2,11,12)
InChIKeyDYFXGAOFIFANPF-UHFFFAOYSA-N
MW304.17 g/mol
LogP2.06
Rot. Bonds4

About 6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine

6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine (PubChem CID 59352792) has the molecular formula C9H10BrN3O2S and a molecular weight of 304.17 g/mol. Its IUPAC name is 6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine.

Molecular Properties

Compound Name6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine
PubChem CID59352792
Molecular FormulaC9H10BrN3O2S
Molecular Weight304.17 g/mol
Exact Mass302.97
IUPAC Name6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine
SMILESCOCCOc1nc2sc(N)nc2cc1Br
InChIInChI=1S/C9H10BrN3O2S/c1-14-2-3-15-7-5(10)4-6-8(13-7)16-9(11)12-6/h4H,2-3H2,1H3,(H2,11,12)
InChIKeyDYFXGAOFIFANPF-UHFFFAOYSA-N
XLogP2.06
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.17
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

5-bromo-6-(2-methoxyethoxy)pyridine-3-carbaldehyde
CID 141397740
5-bromo-4-(2-methoxyethoxy)-N-propylpyrimidin-2-amine
CID 80858542
1-ethyl-3-[5-(2-methoxyethoxy)-6-pyrimidin-5-yl-[1,3]thiazolo[5,4-b]pyridin-2-yl]urea
CID 59352805
6-bromo-5-methoxy-[1,3]thiazolo[4,5-b]pyridin-2-amine;ethane
CID 163251405
4-[(E)-2-[3-bromo-4-(2-methoxyethoxy)phenyl]ethenyl]-1,3-thiazol-2-amine
CID 104658438
3-bromo-5-(2-methoxyethoxy)aniline
CID 103588174
[5-bromo-4-[2-(3-methoxypropoxy)ethoxy]pyrimidin-2-yl]hydrazine
CID 103176581
2-methoxyethyl 2-amino-1,3-benzothiazole-6-carboxylate
CID 3147262
5-bromo-2-[3-(2-methoxyethoxy)propoxy]pyridin-3-amine
CID 103400992
5-bromo-6-(2-ethoxyethoxy)pyridin-3-amine
CID 79534577
2,3-bis[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]thieno[3,4-b]pyrazine
CID 25136770
5-(2-methoxyethoxymethyl)-1,3-thiazol-2-amine
CID 79775147

Frequently Asked Questions

What is the IUPAC name of 6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The IUPAC name of 6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine (CID 59352792) is 6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine.
What is the SMILES notation for 6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The canonical SMILES for 6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine is COCCOc1nc2sc(N)nc2cc1Br.
What is the InChIKey of 6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine?
The InChIKey is DYFXGAOFIFANPF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10BrN3O2S/c1-14-2-3-15-7-5(10)4-6-8(13-7)16-9(11)12-6/h4H,2-3H2,1H3,(H2,11,12).
What are the key properties of 6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine?
6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine has a molecular weight of 304.17 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-5-(2-methoxyethoxy)-[1,3]thiazolo[5,4-b]pyridin-2-amine is sourced from PubChem (CID 59352792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).